Home Other Building Blocks 1-(2-PHENYLACETAMIDO)CYCLOPROPANE-1-CARBOXYLIC ACID

1-(2-PHENYLACETAMIDO)CYCLOPROPANE-1-CARBOXYLIC ACID

CAS No.:
1840325-02-1
Catalog Number:
AG01DZ44
Molecular Formula:
C12H13NO3
Molecular Weight:
219.2365
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Product Description
Catalog Number:
AG01DZ44
Chemical Name:
1-(2-PHENYLACETAMIDO)CYCLOPROPANE-1-CARBOXYLIC ACID
CAS Number:
1840325-02-1
Molecular Formula:
C12H13NO3
Molecular Weight:
219.2365
MDL Number:
MFCD21236886
IUPAC Name:
1-[(2-phenylacetyl)amino]cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C12H13NO3/c14-10(8-9-4-2-1-3-5-9)13-12(6-7-12)11(15)16/h1-5H,6-8H2,(H,13,14)(H,15,16)
InChI Key:
FLQRZSXOEUBGKS-UHFFFAOYSA-N
SMILES:
O=C(Cc1ccccc1)NC1(CC1)C(=O)O
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