Home Aminos Methyl 3-amino-3-(4-nitrophenyl)propanoate

Methyl 3-amino-3-(4-nitrophenyl)propanoate

CAS No.:
273920-24-4
Catalog Number:
AG00IMMV
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
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Product Description
Catalog Number:
AG00IMMV
Chemical Name:
Methyl 3-amino-3-(4-nitrophenyl)propanoate
CAS Number:
273920-24-4
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
MDL Number:
MFCD18907619
IUPAC Name:
methyl 3-amino-3-(4-nitrophenyl)propanoate
InChI:
InChI=1S/C10H12N2O4/c1-16-10(13)6-9(11)7-2-4-8(5-3-7)12(14)15/h2-5,9H,6,11H2,1H3
InChI Key:
JGLLZWBBGQKLKV-UHFFFAOYSA-N
SMILES:
COC(=O)CC(c1ccc(cc1)[N+](=O)[O-])N
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.08g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.216g/mol
Monoisotopic Mass:
224.08g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
98.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties