Home Bromides 774-81-2
774-81-2,MFCD00017538
Catalog No.:AA003IZF
774-81-2 | 3-Bromo-4-methoxyphenylacetic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$15.00   $10.00
- +
5g
98%
in stock  
$33.00   $23.00
- +
25g
98%
in stock  
$99.00   $69.00
- +
100g
98%
in stock  
$279.00   $195.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003IZF
Chemical Name:
3-Bromo-4-methoxyphenylacetic acid
CAS Number:
774-81-2
Molecular Formula:
C9H9BrO3
Molecular Weight:
245.0700
MDL Number:
MFCD00017538
IUPAC Name:
2-(3-bromo-4-methoxyphenyl)acetic acid
InChI:
InChI=1S/C9H9BrO3/c1-13-8-3-2-6(4-7(8)10)5-9(11)12/h2-4H,5H2,1H3,(H,11,12)
InChI Key:
POTVGQUUEQTPNA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1Br)CC(=O)O
Properties
Computed Properties
 
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.974g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.072g/mol
Monoisotopic Mass:
243.974g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Synonyms
 
3-Bromo-4-methoxyphenylacetic acid 
774-81-2 
PubChem12491 
AC1Q4CFA 
AC1L38WS 
AC1Q44LW 
KSC495A9F 
SCHEMBL138449 
RARECHEM AL BO 0336 
CTK3J5092 
KS-00000CBT 
TIMTEC-BB SBB017829 
2-(3-bromo-4-methoxyphenyl)acetic acid 
DTXSID10228112 
OTAVA-BB 1000021 
ZINC391539 
ACN-S004084 
ACT12864 
3-bromo-4-meth-oxyphenylacetic acid 
3-bromo-4-methoxyphenyl acetic acid 
(3-Bromo-4-methoxyphenyl)aceticAcid 
ANW-74666 
BBL027842 
(3-bromo-4-methoxyphenyl)acetic acid 
MFCD00017538 
SBB017829 
STL373481 
AKOS002268767 
AC-2813 
AM82917 
AS00515 
CM13661 
FS-2535 
MCULE-6125953891 
(3-bromo-4-methoxy-phenyl)-acetic acid 
RP28677 
RTR-024755 
TRA0011152 
2-(3-bromo-4-methoxy-phenyl)acetic acid 
AJ-21092 
AN-13622 
BC003660 
FS000801 
SC-22595 
SY003029 
3-Bromo-4-methoxy-phenyl acetic acid 
[3-bromo-4-(methyloxy)phenyl]acetic acid 
2-(3-bromo-4-methoxy-phenyl) acetic acid 
AB0030476 
DB-022348 
TR-024755 
B4677 
CS-0037013 
FT-0632939 
ST24039291 
ST50169430 
Benzeneacetic acid, 3-bromo-4-methoxy- 
TL80090532 
X2674 
MFCD00017538 (98%) 
A22028 
C-5388 
I01-3149 
J-511935 
2-(3-bromo-4-methoxyphenyl)acetic acid;2-(3-bromo-4-methoxy-phenyl)acetic acid 
C9H9BrO3 
CID136615 
POTVGQUUEQTPNA-UHFFFAOYSA-N 
2-(3-Bromo-4-methoxyphenyl)acetic acid 1g 
3-BROMO-4-METHYLOXYPHENYLACETIC ACID 
3-Bromo-4-methoxyphenylaceticacid 
Literature

Title: 2-(3-Bromo-4-meth-oxy-phen-yl)acetic acid.

Journal: Acta crystallographica. Section E, Structure reports online 20100701

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