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71090-29-4 | 2-(NITROMETHYL)-PYRROLIDINE
CAS No: 71090-29-4 Catalog No: AG005OG9 MDL No:
Product Description
Catalog Number:
AG005OG9
Chemical Name:
2-(NITROMETHYL)-PYRROLIDINE
CAS Number:
71090-29-4
Molecular Formula:
C5H10N2O2
Molecular Weight:
130.1451
IUPAC Name:
2-(nitromethyl)pyrrolidine
InChI:
InChI=1S/C5H10N2O2/c8-7(9)4-5-2-1-3-6-5/h5-6H,1-4H2
InChI Key:
CRKPZRVYVNOXJK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)CC1CCCN1
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.074g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
130.147g/mol
Monoisotopic Mass:
130.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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