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51934-39-5

51934-39-5 | 7-Bromo-1-naphthoic acid

CAS No: 51934-39-5 Catalog No: AG0038OB MDL No:MFCD11502678

Product Description

Catalog Number:
AG0038OB
Chemical Name:
7-Bromo-1-naphthoic acid
CAS Number:
51934-39-5
Molecular Formula:
C11H7BrO2
Molecular Weight:
251.0761
MDL Number:
MFCD11502678
IUPAC Name:
7-bromonaphthalene-1-carboxylic acid
InChI:
InChI=1S/C11H7BrO2/c12-8-5-4-7-2-1-3-9(11(13)14)10(7)6-8/h1-6H,(H,13,14)
InChI Key:
OMVHZFPTYXFWFU-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(ccc2)C(=O)O
NSC Number:
74919

Properties

Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.963g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
251.079g/mol
Monoisotopic Mass:
249.963g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

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