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124276-95-5 | Cyclopropanecarboxylic acid, 1-(3-bromophenyl)-
CAS No: 124276-95-5 Catalog No: AG000LS8 MDL No:MFCD07374441
Product Description
Catalog Number:
AG000LS8
Chemical Name:
Cyclopropanecarboxylic acid, 1-(3-bromophenyl)-
CAS Number:
124276-95-5
Molecular Formula:
C10H9BrO2
Molecular Weight:
241.0813
MDL Number:
MFCD07374441
IUPAC Name:
1-(3-bromophenyl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C10H9BrO2/c11-8-3-1-2-7(6-8)10(4-5-10)9(12)13/h1-3,6H,4-5H2,(H,12,13)
InChI Key:
MYDCJGVBYNDHIC-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)C1(CC1)C(=O)O
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.979g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.084g/mol
Monoisotopic Mass:
239.979g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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