Home Bromides 66735-01-1
66735-01-1,MFCD12152839
Catalog No.:AA00FGBK
66735-01-1 | 2-(4-broMobenzyl)propanoic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
96%
in stock  
$85.00
- +
1g
96%
in stock  
$289.00
- +
5g
96%
in stock  
$878.00
- +
10g
96%
in stock  
$1,245.00
- +
  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00FGBK
Chemical Name:
2-(4-broMobenzyl)propanoic acid
CAS Number:
66735-01-1
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.0971
MDL Number:
MFCD12152839
IUPAC Name:
3-(4-bromophenyl)-2-methylpropanoic acid
InChI:
InChI=1S/C10H11BrO2/c1-7(10(12)13)6-8-2-4-9(11)5-3-8/h2-5,7H,6H2,1H3,(H,12,13)
InChI Key:
KIXVFBKJEAPPAR-UHFFFAOYSA-N
SMILES:
CC(C(=O)O)Cc1ccc(cc1)Br
Properties
Computed Properties
 
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.994g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.1g/mol
Monoisotopic Mass:
241.994g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

Synonyms
 
3-(4-Bromophenyl)-2-methylpropanoic acid 
66735-01-1 
KM1033 
MFCD12152839 
AKOS005217878 
MCULE-6683812666 
RP05927 
2-methyl-3-(4-bromophenyl)propanoic acid 
TC-154951 
Y5507 
J-505907 
Z1552027309 
2-(4-Bromobenzyl)propanoic acid 
C10H11BrO2 
3-(4-Bromophenyl)-2-methylpropanoicacid 
2-(4-bromobenzyl)propanoic acid, 95% - 1G 1g 
1040274-42-7 
3-(4-Bromophenyl)-2-methylpropionic acid 
(2S)-3-(4-bromophenyl)-2-methylpropanoic acid 
SCHEMBL4597385 
CTK8C1297 
DTXSID00617253 
KIXVFBKJEAPPAR-UHFFFAOYSA-N 
ANW-66206 
Literature
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