200,000+ products from a single source!
sales@angenechem.com
89315-40-2 | 1,2-Propanediol, 3-(9-octadecenyloxy)-, diacetate
CAS No: 89315-40-2 Catalog No: AG003ZWY MDL No:
Product Description
Catalog Number:
AG003ZWY
Chemical Name:
1,2-Propanediol, 3-(9-octadecenyloxy)-, diacetate
CAS Number:
89315-40-2
Molecular Formula:
C25H50O7
Molecular Weight:
462.6603
IUPAC Name:
acetic acid;3-octadec-9-enoxypropane-1,2-diol
InChI:
InChI=1S/C21H42O3.2C2H4O2/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/h9-10,21-23H,2-8,11-20H2,1H3;2*1H3,(H,3,4)
InChI Key:
WJOCFNAWFHLOTM-UHFFFAOYSA-N
SMILES:
CC(=O)O.CC(=O)O.CCCCCCCCC=CCCCCCCCCOCC(CO)O
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
462.356g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
462.668g/mol
Monoisotopic Mass:
462.356g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.