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115440-59-0 | Ethanol, 2-(nitrosopropylamino)-
CAS No: 115440-59-0 Catalog No: AG000G0M MDL No:
Product Description
Catalog Number:
AG000G0M
Chemical Name:
Ethanol, 2-(nitrosopropylamino)-
CAS Number:
115440-59-0
Molecular Formula:
C5H12N2O2
Molecular Weight:
132.1610
IUPAC Name:
N-(2-hydroxyethyl)-N-propylnitrous amide
InChI:
InChI=1S/C5H12N2O2/c1-2-3-7(6-9)4-5-8/h8H,2-5H2,1H3
InChI Key:
KFMAUQFBLBZXOL-UHFFFAOYSA-N
SMILES:
OCCNCCCN=O
Properties
Complexity:
77.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.09g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
132.163g/mol
Monoisotopic Mass:
132.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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