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Home > Nitro Compounds > 94662-62-1
94662-62-1 | (2Z)-2-(nitromethylidene)pyrrolidine
CAS No: 94662-62-1 Catalog No: AG01ELZY MDL No:MFCD00790775
Product Description
Catalog Number:
AG01ELZY
Chemical Name:
(2Z)-2-(nitromethylidene)pyrrolidine
CAS Number:
94662-62-1
Molecular Formula:
C5H8N2O2
Molecular Weight:
128.1292
MDL Number:
MFCD00790775
IUPAC Name:
(2Z)-2-(nitromethylidene)pyrrolidine
InChI:
InChI=1S/C5H8N2O2/c8-7(9)4-5-2-1-3-6-5/h4,6H,1-3H2/b5-4-
InChI Key:
LKMGDZMCCPSUFI-PLNGDYQASA-N
SMILES:
[O-][N+](=O)/C=C\1/CCCN1
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
128.059g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
128.131g/mol
Monoisotopic Mass:
128.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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