Home Other Building Blocks 2-cyclopropyl-2-acetamidopropanoic acid

2-cyclopropyl-2-acetamidopropanoic acid

CAS No.:
95525-82-9
Catalog Number:
AG01AA4R
Molecular Formula:
C8H13NO3
Molecular Weight:
171.1937
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Product Description
Catalog Number:
AG01AA4R
Chemical Name:
2-cyclopropyl-2-acetamidopropanoic acid
CAS Number:
95525-82-9
Molecular Formula:
C8H13NO3
Molecular Weight:
171.1937
MDL Number:
MFCD11105889
IUPAC Name:
2-acetamido-2-cyclopropylpropanoic acid
InChI:
InChI=1S/C8H13NO3/c1-5(10)9-8(2,7(11)12)6-3-4-6/h6H,3-4H2,1-2H3,(H,9,10)(H,11,12)
InChI Key:
VWQKLKHJGPCATE-UHFFFAOYSA-N
SMILES:
CC(=O)NC(C1CC1)(C(=O)O)C
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.09g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
171.196g/mol
Monoisotopic Mass:
171.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties