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Home > Aldehydes > 675739-27-2
675739-27-2 | Formaldehyde, compd. with acetonitrile (1:1)
CAS No: 675739-27-2 Catalog No: AG005ZL8 MDL No:
Product Description
Catalog Number:
AG005ZL8
Chemical Name:
Formaldehyde, compd. with acetonitrile (1:1)
CAS Number:
675739-27-2
Molecular Formula:
C3H5NO
Molecular Weight:
71.0779
IUPAC Name:
acetonitrile;formaldehyde
InChI:
InChI=1S/C2H3N.CH2O/c1-2-3;1-2/h1H3;1H2
InChI Key:
LUMZBWGOECKOAO-UHFFFAOYSA-N
SMILES:
CC#N.C=O
Properties
Complexity:
31.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
71.037g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
71.079g/mol
Monoisotopic Mass:
71.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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