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10152-41-7

10152-41-7 | 1,2-Propanediol, 3-(octadecyloxy)-, diacetate, (2R)- (9CI)

CAS No: 10152-41-7 Catalog No: AG0004Q0 MDL No:

Product Description

Catalog Number:
AG0004Q0
Chemical Name:
1,2-Propanediol, 3-(octadecyloxy)-, diacetate, (2R)- (9CI)
CAS Number:
10152-41-7
Molecular Formula:
C25H48O5
Molecular Weight:
428.6456
IUPAC Name:
acetic acid;(2R)-3-octadecoxypropane-1,2-diol
InChI:
InChI=1S/C21H44O3.2C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-20-21(23)19-22;2*1-2(3)4/h21-23H,2-20H2,1H3;2*1H3,(H,3,4)/t21-;;/m1../s1
InChI Key:
PDQCTTLHIPRYCI-GHVWMZMZSA-N
SMILES:
CCCCCCCCCCCCCCCCCCOC[C@@H](OC(=O)C)COC(=O)C

Properties

Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
464.371g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
464.684g/mol
Monoisotopic Mass:
464.371g/mol
Rotatable Bond Count:
20  
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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