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101083-60-7

101083-60-7 | Dodecanoic acid, 3-bromopropyl ester

CAS No: 101083-60-7 Catalog No: AG0003PK MDL No:

Product Description

Catalog Number:
AG0003PK
Chemical Name:
Dodecanoic acid, 3-bromopropyl ester
CAS Number:
101083-60-7
Molecular Formula:
C15H29BrO2
Molecular Weight:
321.2936
IUPAC Name:
3-bromopropyl dodecanoate
InChI:
InChI=1S/C15H29BrO2/c1-2-3-4-5-6-7-8-9-10-12-15(17)18-14-11-13-16/h2-14H2,1H3
InChI Key:
UHLLYODWSSYYNQ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC(=O)OCCCBr

Properties

Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.135g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
321.299g/mol
Monoisotopic Mass:
320.135g/mol
Rotatable Bond Count:
14  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4  

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