Home Other Building Blocks 2-[(cyclopropylmethyl)carbamoyl]acetic acid

2-[(cyclopropylmethyl)carbamoyl]acetic acid

CAS No.:
773099-97-1
Catalog Number:
AG01BDTI
Molecular Formula:
C7H11NO3
Molecular Weight:
157.1671
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Product Description
Catalog Number:
AG01BDTI
Chemical Name:
2-[(cyclopropylmethyl)carbamoyl]acetic acid
CAS Number:
773099-97-1
Molecular Formula:
C7H11NO3
Molecular Weight:
157.1671
MDL Number:
MFCD06208737
IUPAC Name:
3-(cyclopropylmethylamino)-3-oxopropanoic acid
InChI:
InChI=1S/C7H11NO3/c9-6(3-7(10)11)8-4-5-1-2-5/h5H,1-4H2,(H,8,9)(H,10,11)
InChI Key:
KEXOYFANUQHTKS-UHFFFAOYSA-N
SMILES:
O=C(CC(=O)O)NCC1CC1
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.074g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
157.169g/mol
Monoisotopic Mass:
157.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties