Home Bromides 1013-83-8
1013-83-8,MFCD08236734
Catalog No.:AA00043Y
1013-83-8 | 5-Bromo-2-naphthoic acid
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1g
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Technical Information
Catalog Number:
AA00043Y
Chemical Name:
5-Bromo-2-naphthoic acid
CAS Number:
1013-83-8
Molecular Formula:
C11H7BrO2
Molecular Weight:
251.0761
MDL Number:
MFCD08236734
IUPAC Name:
5-bromonaphthalene-2-carboxylic acid
InChI:
InChI=1S/C11H7BrO2/c12-10-3-1-2-7-6-8(11(13)14)4-5-9(7)10/h1-6H,(H,13,14)
InChI Key:
QPOQPJDDJJNVRY-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)cccc2Br
Properties
Computed 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:
3.4  

Synonyms
 
5-BROMO-2-NAPHTHOIC ACID 
1013-83-8 
KS-000025YQ 
ANW-49001 
MFCD08236734 
QC-846 
ZINC21297210 
5-bromo-naphthalene-2-carboxylic acid 
AKOS005067145 
AB43882 
CS-W022315 
GS-3960 
5-Bromonaphthalene-2-carboxylic acid 
RP28932 
RP28934 
AJ-78096 
AK-28350 
BR-28350 
SC-44409 
AB0034407 
DB-014561 
ST2411819 
TL8000089 
2-NAPHTHALENECARBOXYLIC ACID, 5-BROMO- 
TX-017174 
4CH-006571 
5-BROMO-2-NAPHTHALENECARBOXYLIC ACID 
AM20020079 
FT-0649455 
X8560 
S-6051 
I04-1402 
J-516983 
Z1741978628 
2-Naphthalenecarboxylicacid, 5-bromo- 
C11H7BrO2 
5-bromo-2-napthoic acid 
SCHEMBL3106132 
CTK0H1607 
DTXSID50566121 
QPOQPJDDJJNVRY-UHFFFAOYSA-N 
Literature
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