Cas no 100863-37-4 (1-Heptanone,1-(3-methoxyphenyl)-)
100863-37-4 structure
Product Name:1-Heptanone,1-(3-methoxyphenyl)-
CAS No:100863-37-4
MF:C14H20O2
MW:220.307404518127
MDL:MFCD08276976
CID:124274
PubChem ID:24883717
Update Time:2025-09-20
1-Heptanone,1-(3-methoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Heptanone,1-(3-methoxyphenyl)-
- 1-(3-methoxyphenyl)heptan-1-one
- 1-(3-Methoxyphenyl)-1-heptanone
- 1-(3-Methoxy-phenyl)-heptan-1-on
- 1-(3-methoxyphenyl)-heptan-1-one
- 1-(3-methoxy-phenyl)-heptan-1-one
- 3-Heptanoylanisole
- 649899_ALDRICH
- ACMC-20apbg
- AGN-PC-000YOT
- CTK3J9317
- Heptanophenone,3'-methoxy- (6CI)
- SureCN4884718
- FIRIFBOVXOXLTG-UHFFFAOYSA-N
- AKOS011914057
- SCHEMBL4884718
- 1-(3-Methoxyphenyl)-1-heptanone, 97%
- 1-(3-METHOXYPHENYL)-1-HEPTANONE 97
- 100863-37-4
- DTXSID40558550
- J-000240
- 1-(3-Methoxyphenyl)heptan-1-one,97%
-
- MDL: MFCD08276976
- Inchi: 1S/C14H20O2/c1-3-4-5-6-10-14(15)12-8-7-9-13(11-12)16-2/h7-9,11H,3-6,10H2,1-2H3
- InChI Key: FIRIFBOVXOXLTG-UHFFFAOYSA-N
- SMILES: O=C(C1C=CC=C(C=1)OC)CCCCCC
Computed Properties
- Exact Mass: 220.1464
- Monoisotopic Mass: 220.146329876g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 7
- Complexity: 201
- 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
- XLogP3: 4.3
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 0.968
- Boiling Point: 139-144?°C/0.5?mmHg(lit.)
- Flash Point: Degrees Fahrenheit:>230°F
Degrees Celsius:>110°C - Refractive Index: 1.493
- PSA: 26.3
- LogP: 3.84830
1-Heptanone,1-(3-methoxyphenyl)- Security Information
-
Symbol:
- Signal Word:Warning
- Hazard Statement: H302-H319-H411
- Warning Statement: P273-P305+P351+P338
- Hazardous Material transportation number:UN 3082 9/PG 3
- WGK Germany:2
- Hazard Category Code: 22-36-51/53
- Safety Instruction: 26-36/37-61
-
Hazardous Material Identification:
- Risk Phrases:R22
- Safety Term:S26-36/37-61
1-Heptanone,1-(3-methoxyphenyl)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | 649899-10G |
1-Heptanone,1-(3-methoxyphenyl)- |
100863-37-4 | 10g |
¥1433.68 | 2023-12-01 | ||
| abcr | AB433110-1 g |
1-(3-Methoxyphenyl)heptan-1-one |
100863-37-4 | 1g |
€516.00 | 2022-03-02 | ||
| Ambeed | A177363-1g |
1-(3-Methoxyphenyl)heptan-1-one |
100863-37-4 | 97% | 1g |
$482.0 | 2024-04-26 | |
| abcr | AB433110-1g |
1-(3-Methoxyphenyl)heptan-1-one |
100863-37-4 | 1g |
€635.40 | 2023-09-04 |
1-Heptanone,1-(3-methoxyphenyl)- Related Literature
-
Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
-
Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
100863-37-4 (1-Heptanone,1-(3-methoxyphenyl)-) Related Products
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