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Home > Aldehydes > 190450-96-5
190450-96-5 | 2-Oxirenecarboxaldehyde, 3-amino-
CAS No: 190450-96-5 Catalog No: AG002EKS MDL No:
Product Description
Catalog Number:
AG002EKS
Chemical Name:
2-Oxirenecarboxaldehyde, 3-amino-
CAS Number:
190450-96-5
Molecular Formula:
C3H3NO2
Molecular Weight:
85.0614
IUPAC Name:
3-aminooxirene-2-carbaldehyde
InChI:
InChI=1S/C3H3NO2/c4-3-2(1-5)6-3/h1H,4H2
InChI Key:
SEPNMMOEXVOWDN-UHFFFAOYSA-N
SMILES:
NC1=C(O1)C=O
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
85.016g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
85.062g/mol
Monoisotopic Mass:
85.016g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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