Home Halogens Cyclopentanecarboxylic acid, 3-bromo-, methyl ester

Cyclopentanecarboxylic acid, 3-bromo-, methyl ester

CAS No.:
1311312-00-1
Catalog Number:
AG000VLD
Molecular Formula:
C7H11BrO2
Molecular Weight:
207.0650
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Product Description
Catalog Number:
AG000VLD
Chemical Name:
Cyclopentanecarboxylic acid, 3-bromo-, methyl ester
CAS Number:
1311312-00-1
Molecular Formula:
C7H11BrO2
Molecular Weight:
207.0650
IUPAC Name:
methyl 3-bromocyclopentane-1-carboxylate
InChI:
InChI=1S/C7H11BrO2/c1-10-7(9)5-2-3-6(8)4-5/h5-6H,2-4H2,1H3
InChI Key:
NBNSTTSIQITBMQ-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCC(C1)Br
Properties
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.994g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.067g/mol
Monoisotopic Mass:
205.994g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties