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144549-65-5

144549-65-5 | Oxirane, 2-(18-nonadecenyl)-3-octyl-, cis- (9CI)

CAS No: 144549-65-5 Catalog No: AG001JQS MDL No:

Product Description

Catalog Number:
AG001JQS
Chemical Name:
Oxirane, 2-(18-nonadecenyl)-3-octyl-, cis- (9CI)
CAS Number:
144549-65-5
Molecular Formula:
C29H56O
Molecular Weight:
420.7543
IUPAC Name:
2-nonadec-18-enyl-3-octyloxirane
InChI:
InChI=1S/C29H56O/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-23-25-27-29-28(30-29)26-24-22-10-8-6-4-2/h3,28-29H,1,4-27H2,2H3
InChI Key:
JMPGIFUNOCYZNZ-UHFFFAOYSA-N
SMILES:
CCCCCCCC[C@H]1O[C@H]1CCCCCCCCCCCCCCCCCC=C

Properties

Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
420.433g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
420.766g/mol
Monoisotopic Mass:
420.433g/mol
Rotatable Bond Count:
25  
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
13.3  

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