Home Carboxys 1-(Benzylcarbamoyl)cyclopropane-1-carboxylic acid

1-(Benzylcarbamoyl)cyclopropane-1-carboxylic acid

CAS No.:
196211-13-9
Catalog Number:
AG00ASVD
Molecular Formula:
C12H13NO3
Molecular Weight:
219.2365
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$157
- +
1g
98%
In Stock USA
United States
$313
- +
5g
98%
In Stock USA
United States
$1100
- +
Product Description
Catalog Number:
AG00ASVD
Chemical Name:
1-(Benzylcarbamoyl)cyclopropane-1-carboxylic acid
CAS Number:
196211-13-9
Molecular Formula:
C12H13NO3
Molecular Weight:
219.2365
MDL Number:
MFCD16676101
IUPAC Name:
1-(benzylcarbamoyl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C12H13NO3/c14-10(12(6-7-12)11(15)16)13-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,13,14)(H,15,16)
InChI Key:
ZIPURTBBOFIUNR-UHFFFAOYSA-N
SMILES:
O=C(C1(CC1)C(=O)O)NCc1ccccc1
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.09g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
219.24g/mol
Monoisotopic Mass:
219.09g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties