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76919-68-1

76919-68-1 | Glycine,N-(2-nitroethyl)-, methyl ester

CAS No: 76919-68-1 Catalog No: AG0057QC MDL No:

Product Description

Catalog Number:
AG0057QC
Chemical Name:
Glycine,N-(2-nitroethyl)-, methyl ester
CAS Number:
76919-68-1
Molecular Formula:
C5H10N2O4
Molecular Weight:
162.1439
IUPAC Name:
methyl 2-(2-nitroethylamino)acetate
InChI:
InChI=1S/C5H10N2O4/c1-11-5(8)4-6-2-3-7(9)10/h6H,2-4H2,1H3
InChI Key:
XYRXVHXKJOMZPK-UHFFFAOYSA-N
SMILES:
COC(=O)CNCC[N+](=O)[O-]

Properties

Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.064g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
162.145g/mol
Monoisotopic Mass:
162.064g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  

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