Cas no 111-13-7 (2-Octanone)

2-Octanone structure
2-Octanone structure
Product Name:2-Octanone
CAS No:111-13-7
MF:C16H32O2
MW:256.424085617065
MDL:MFCD00009540
CID:35662
PubChem ID:24845301
Update Time:2025-04-18

2-Octanone Chemical and Physical Properties

Names and Identifiers

    • Octan-2-one
    • n-Hexyl methyl ketone
    • Methyl hexyl ketone
    • SEC-OCTANONE
    • OCTANONE,2-
    • MHK
    • FEMA 2802
    • HEXYL METHYL KETONE
    • METHYL N-HEXYL KETONE
    • 2-Octanone
    • 2-Octanoneneat
    • OCTANONE, 2-(AS)
    • 1-methoxy-hexane
    • Ether,hexyl methyl
    • Hexane,1-methoxy
    • hexylmethyl ether
    • methoxyhexane
    • Methyl hexyl ether
    • Methyl-n-Hexyl ether
    • n-Hexyl Methyl Ether
    • octane 2-oxide
    • octan-2-
    • 2-Octanon
    • Octan-2-on
    • 2-OCLanone
    • 2-oxooctane
    • Octanone
    • 2-Octanone (natural)
    • FEMA Number 2802
    • FEMA No. 2802
    • J2G84H29AF
    • ZPVFWPFBNIEHGJ-UHFFFAOYSA-N
    • octanone-2
    • 2- octanone
    • Metyhl Hexyl Ketone
    • KSC176M5B
    • MDL： MFCD00009540
    • Inchi： 1S/2C8H16O/c2*1-3-4-5-6-7-8(2)9/h3-7H2,1-2H3;9H,2-7H2,1H3
    • InChI Key： CCTBOAOFJPIIOU-UHFFFAOYSA-N
    • SMILES： CCCCCCC(=O)C.CCCCCCC(=C)O
    • BRN： 0635843

Computed Properties

  • Exact Mass: 128.12000
  • Monoisotopic Mass: 128.120115
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 5
  • Complexity: 76.6
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 3
  • XLogP3: 2.4
  • Topological Polar Surface Area: 17.1

Experimental Properties

  • Color/Form: Colorless to yellowish liquid, with floral and grassy aromas, accompanied by the aroma of sweet clover.
  • Density: 0.819?g/mL?at 25?°C(lit.)
  • Melting Point: ?16?°C (lit.)
  • Boiling Point: 173?°C(lit.)
  • Flash Point: Fahrenheit: 132.8 ° f < br / > Celsius: 56 ° C < br / >
  • Refractive Index: n20/D 1.416(lit.)
  • Solubility: 0.9g/l
  • Water Partition Coefficient: 0.9 g/L
  • Stability/Shelf Life: Stable. Incompatible with strong oxidizing agents. Flammable.
  • PSA: 17.07000
  • LogP: 2.54580
  • FEMA: 2802
  • Merck: 4711
  • Solubility: It is slightly soluble in water, 0.09% in water at 20 ℃, and 0.6% in 2-octanone. It can be miscible with ether, alcohol and other organic solvents.

2-Octanone Security Information

  • Symbol: GHS02 GHS07
  • Prompt：warning
  • Signal Word：Warning
  • Hazard Statement： H226,H312
  • Warning Statement： P280
  • Hazardous Material transportation number：UN 1224 3/PG 3
  • WGK Germany：1
  • Hazard Category Code： 21
  • Safety Instruction： S36/37-S16
  • RTECS：RH1484000
  • Hazardous Material Identification： Xn
  • HazardClass：3
  • PackingGroup：III
  • TSCA：Yes
  • Safety Term：S16;S36/37
  • Packing Group：I; II; III
  • Packing Group：I; II; III
  • Risk Phrases：R10; R21
  • Storage Condition：Keep away from high temperature, sparks, flames and fire sources. Store in tightly closed containers. Store in a cool, dry, well ventilated area away from incompatible substances.

2-Octanone Customs Data

  • HS CODE：29141990
  • Customs Data：

    China Customs Code:

    2914190090

    Overview:

    2914190090 Other acyclic ketones without other oxygen-containing groups.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acetone declared packaging

    Summary:

    2914190090 other acyclic ketones without other oxygen function.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%

2-Octanone Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
NAN JING HUA XUE SHI JI GU FEN Co., Ltd.
C0720539435- 100ml（玻瓶）
2-Octanone
 111-13-7 98%
100ml
 ￥ 89.1 2021-05-18
NAN JING HUA XUE SHI JI GU FEN Co., Ltd.
C0720539423- 500ml（玻瓶）
2-Octanone
 111-13-7 98%
500ml
 ￥ 205.9 2021-05-18
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
O111187-5ml
2-Octanone
 111-13-7 ,≥99.5%(GC)
5ml
 ￥665.90 2023-09-01
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
O111187-1ml
2-Octanone
 111-13-7 ,≥99.5%(GC)
1ml
 ￥201.90 2023-09-01
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
O111186-100ml
2-Octanone
 111-13-7 98%
100ml
 ￥58.90 2023-09-01
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
O111186-10L
2-Octanone
 111-13-7 98%
10l
 ￥1750.90 2023-09-01
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
O111186-2.5L
2-Octanone
 111-13-7 98%
2.5l
 ￥648.90 2023-09-01
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
O111186-25ml
2-Octanone
 111-13-7 98%
25ml
 ￥32.90 2023-09-01
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
O111186-500ml
2-Octanone
 111-13-7 98%
500ml
 ￥150.90 2023-09-01
SHANG HAI YI EN HUA XUE JI SHU Co., Ltd.
R002021-5L
2-Octanone
 111-13-7 98%
5l
 ￥1141 2024-05-26

2-Octanone Production Method

2-Octanone Suppliers

Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:111-13-7)2-Octanone
Order Number:sfd10718
Stock Status:in Stock
Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:35
Price ($):discuss personally
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:111-13-7)2-Octanone
Order Number:LE14091;LE5872257
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:10
Price ($):discuss personally

2-Octanone Related Literature

Related Categories

111-13-7 (2-Octanone) Related Products

Recommended suppliers
Suzhou Senfeida Chemical Co., Ltd
(CAS:111-13-7)2-Octanone
sfd10718
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
Email
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:111-13-7)2-Octanone
LE14091;LE5872257
Purity:99%/99%
Quantity:25KG,200KG,1000KG/25KG,200KG,1000KG
Price ($):Inquiry/Inquiry
Email