Cas no 82469-79-2 (trihexyl O-butyrylcitrate)

trihexyl O-butyrylcitrate structure
trihexyl O-butyrylcitrate structure
Product Name:trihexyl O-butyrylcitrate
CAS No:82469-79-2
MF:C28H50O8
MW:514.691810131073
CID:60447
Update Time:2024-01-22

trihexyl O-butyrylcitrate Chemical and Physical Properties

Names and Identifiers

    • trihexyl O-butyrylcitrate
    • BTHC
    • trihexyl 2-butanoyloxypropane-1,2,3-tricarboxylate
    • Citroflex? B-6
    • N-BUTYRYL TRI-N-HEXYL CITRATE
    • 1,2,3-Propanetricarboxylicacid, 2-(1-oxobutoxy)-, trihexyl ester (9CI)
    • Butyryl tri-n-hexyl citrate
    • Citroflex B 6
    • Trihexyl butyrylcitrate
    • Trihexyl citrate butyrate
    • 1,2,3-Propanetricarboxylic acid, 2-(1-oxobutoxy)-, trihexyl ester (9CI)
    • Butyryl trihexyl citrate
    • Inchi: 1S/C28H50O8/c1-5-9-12-15-19-33-25(30)22-28(36-24(29)18-8-4,27(32)35-21-17-14-11-7-3)23-26(31)34-20-16-13-10-6-2/h5-23H2,1-4H3
    • InChI Key: GWVUTNGDMGTPFE-UHFFFAOYSA-N
    • SMILES: O=C(CCC)OC(CC(OCCCCCC)=O)(CC(OCCCCCC)=O)C(OCCCCCC)=O

Computed Properties

  • Exact Mass: 514.35100
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 36
  • Rotatable Bond Count: 27
  • Complexity: 589
  • 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
  • XLogP3: 7.4
  • Topological Polar Surface Area: 105

Experimental Properties

  • Color/Form: Not determined
  • Density: 0.993
  • Melting Point: ?55?°C(lit.)
  • Boiling Point: 520.24°C (rough estimate)
  • Flash Point: 113?°C
  • Refractive Index: n20/D 1.448(lit.)
  • PSA: 105.20000
  • LogP: 6.21920
  • Solubility: Not determined

trihexyl O-butyrylcitrate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
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Trihexyl O-Butyrylcitrate
82469-79-2 ≥92%(GC)
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trihexyl O-butyrylcitrate Suppliers

Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:82469-79-2)n-Butyryl tri-n-hexyl citrate
Order Number:sfd20523
Stock Status:in Stock
Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:38
Price ($):discuss personally
Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:82469-79-2)trihexyl O-butyrylcitrate
Order Number:A1207181
Stock Status:in Stock
Quantity:500g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 15:57
Price ($):240.0
Recommended suppliers
Suzhou Senfeida Chemical Co., Ltd
(CAS:82469-79-2)n-Butyryl tri-n-hexyl citrate
sfd20523
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
Email
Amadis Chemical Company Limited
(CAS:82469-79-2)trihexyl O-butyrylcitrate
A1207181
Purity:99%
Quantity:500g
Price ($):240.0
Email