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Home Carboxys 1-Phenylcyclopropanecarboxylic acid

1-Phenylcyclopropanecarboxylic acid

CAS No.:
6120-95-2
Catalog Number:
AG00E8QU
Molecular Formula:
C10H10O2
Molecular Weight:
162.1852
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$13
- +
5g
97%
In Stock USA
United States
$25
- +
25g
97%
In Stock USA
United States
$88
- +
100g
97%
In Stock USA
United States
$250
- +
500g
97%
In Stock USA
United States
$1188
- +
Product Description
Catalog Number:
AG00E8QU
Chemical Name:
1-Phenylcyclopropanecarboxylic acid
CAS Number:
6120-95-2
Molecular Formula:
C10H10O2
Molecular Weight:
162.1852
MDL Number:
MFCD00001288
IUPAC Name:
1-phenylcyclopropane-1-carboxylic acid
InChI:
InChI=1S/C10H10O2/c11-9(12)10(6-7-10)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)
InChI Key:
IWWCCNVRNHTGLV-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CC1)c1ccccc1
EC Number:
228-090-9
NSC Number:
154619
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.068g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
162.188g/mol
Monoisotopic Mass:
162.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
N,N-Dimethylpyridin-4-aminium 1-phenyl-cyclo-pentane-1-carboxyl-ate monohydrate. Acta crystallographica. Section E, Structure reports online 20110501
2-Amino-pyridinium 1-phenyl-cyclo-propane-1-carboxyl-ate. Acta crystallographica. Section E, Structure reports online 20101201
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties