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2528-39-4 | Trihexyl phosphate
CAS No: 2528-39-4 Catalog No: AG003V2N MDL No:MFCD00015351
Product Description
Catalog Number:
AG003V2N
Chemical Name:
Trihexyl phosphate
CAS Number:
2528-39-4
Molecular Formula:
C18H39O4P
Molecular Weight:
350.4736
MDL Number:
MFCD00015351
IUPAC Name:
trihexyl phosphate
InChI:
InChI=1S/C18H39O4P/c1-4-7-10-13-16-20-23(19,21-17-14-11-8-5-2)22-18-15-12-9-6-3/h4-18H2,1-3H3
InChI Key:
SFENPMLASUEABX-UHFFFAOYSA-N
SMILES:
CCCCCCOP(=O)(OCCCCCC)OCCCCCC
EC Number:
219-774-8
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.259g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
350.48g/mol
Monoisotopic Mass:
350.259g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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