Home Carboxes 3508-94-9
3508-94-9,MFCD00021708
Catalog No.:AA003HER
3508-94-9 | 2-Isopropyl-2-phenylacetic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$57.00   $40.00
- +
5g
97%
in stock  
$157.00   $110.00
- +
10g
95%
in stock  
$212.00   $148.00
- +
25g
95%
in stock  
$442.00   $309.00
- +
  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA003HER
Chemical Name:
2-Isopropyl-2-phenylacetic acid
CAS Number:
3508-94-9
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
MDL Number:
MFCD00021708
IUPAC Name:
3-methyl-2-phenylbutanoic acid
InChI:
InChI=1S/C11H14O2/c1-8(2)10(11(12)13)9-6-4-3-5-7-9/h3-8,10H,1-2H3,(H,12,13)
InChI Key:
HDLQGISFYDYWFJ-UHFFFAOYSA-N
SMILES:
CC(C(c1ccccc1)C(=O)O)C
NSC Number:
22982
Properties
Computed Properties
 
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.099g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.231g/mol
Monoisotopic Mass:
178.099g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

Synonyms
 
3508-94-9 
3-methyl-2-phenylbutanoic acid 
HDLQGISFYDYWFJ-UHFFFAOYSA-N 
MFCD00021708 
25329-47-9 
(2R)-3-methyl-2-phenylbutanoic acid 
AK-58328 
AK162327 
2-Phenylisovaleric acid 
AC1L2DAU 
ACMC-1BN3M 
AC1Q1O1A 
alpha-Isopropylphenylacetic acid 
AC1Q1O1B 
SCHEMBL66944 
Benzeneacetic acid, alpha-(1-methylethyl)- (9CI) 
alpha-IsopropylphenylaceticAcid 
2-phenyl-3-methylbutyric acid 
2-phenyl-3-methyl-butanoic acid 
3-methyl-2-phenyl-butanoic acid 
CTK4F5488 
KS-00000D0I 
NSC22982 
2-ISOPROPYL-2-PHENYLACETIC ACID 
ANW-66412 
NSC-22982 
SBB071437 
(2S)-3-Methyl-2-phenylbutyric acid 
AKOS009158545 
MCULE-9741733290 
NE22786 
VZ24816 
AC-29624 
AK-49719 
3-Methyl-2-phenylbutyric acid 
AS-39413 
LS-48117 
ST092715 
SY025358 
SY025441 
DB-021246 
TC-155157 
4CH-018395 
CS-0059235 
FT-0622166 
3-Methyl-2-phenyl-butyric acid 
Benzeneacetic acid, .alpha.-(1-methylethyl)- 
EN300-93753 
MFCD00167435 (95%) 
MFCD11505969 (95%) 
I04-11989 
Z1269638426 
Benzeneacetic acid, a-(1-methylethyl)-, sodium salt(1:1) 
(R)-3-Methyl-2-phenylbutanoic acid 
(S)-3-methyl-2-phenylbutanoic acid 
3-methyl-2-phenyl-butanoicacid 
NSC 22982 
CID19024 
(R)-2-Phenyl-3-methylbutanoic acid 
(2S)-3-methyl-2-phenylbutanoic acid 
ACN-030108 
C11-H14-O2 
13491-13-9 
3-09-00-02518 (Beilstein Handbook Reference) 
(2R,6R)-2,6-Dimethylpiperazine dihydrochloride 
13490-69-2 
BRN 2045915 
BUTYRIC ACID, 3-METHYL-2-PHENYL- 
Benzeneacetic acid, alpha-(1-methylethyl)- 
Literature
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