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Home > Bromides > 1215206-32-8
1215206-32-8 | [1,1'-Biphenyl]-3-carboxylic acid, 3'-bromo-4'-methoxy-
CAS No: 1215206-32-8 Catalog No: AG00156X MDL No:MFCD15143539
Product Description
Catalog Number:
AG00156X
Chemical Name:
[1,1'-Biphenyl]-3-carboxylic acid, 3'-bromo-4'-methoxy-
CAS Number:
1215206-32-8
Molecular Formula:
C14H11BrO3
Molecular Weight:
307.1393
MDL Number:
MFCD15143539
IUPAC Name:
3-(3-bromo-4-methoxyphenyl)benzoic acid
InChI:
InChI=1S/C14H11BrO3/c1-18-13-6-5-10(8-12(13)15)9-3-2-4-11(7-9)14(16)17/h2-8H,1H3,(H,16,17)
InChI Key:
AAYOTNRWOUSBAC-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1Br)c1cccc(c1)C(=O)O
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.989g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.143g/mol
Monoisotopic Mass:
305.989g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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