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Home Other Building Blocks (4-Butylphenyl)acetic acid

(4-Butylphenyl)acetic acid

CAS No.:
14377-19-6
Catalog Number:
AG001ICE
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$69
- +
1g
98%
In Stock USA
United States
$200
- +
5g
98%
In Stock USA
United States
$588
- +
10g
98%
In Stock USA
United States
$869
- +
Product Description
Catalog Number:
AG001ICE
Chemical Name:
(4-Butylphenyl)acetic acid
CAS Number:
14377-19-6
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
MDL Number:
MFCD00982001
IUPAC Name:
2-(4-butylphenyl)acetic acid
InChI:
InChI=1S/C12H16O2/c1-2-3-4-10-5-7-11(8-6-10)9-12(13)14/h5-8H,2-4,9H2,1H3,(H,13,14)
InChI Key:
ROVMLIKBAVUPPB-UHFFFAOYSA-N
SMILES:
CCCCc1ccc(cc1)CC(=O)O
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.115g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.258g/mol
Monoisotopic Mass:
192.115g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties