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14631-44-8 | 3-FURANCARBONITRILE, TETRAHYDRO-
CAS No: 14631-44-8 Catalog No: AG001DWG MDL No:MFCD08669507
Product Description
Catalog Number:
AG001DWG
Chemical Name:
3-FURANCARBONITRILE, TETRAHYDRO-
CAS Number:
14631-44-8
Molecular Formula:
C5H7NO
Molecular Weight:
97.1152
MDL Number:
MFCD08669507
IUPAC Name:
oxolane-3-carbonitrile
InChI:
InChI=1S/C5H7NO/c6-3-5-1-2-7-4-5/h5H,1-2,4H2
InChI Key:
OANDNNNKGULGJK-UHFFFAOYSA-N
SMILES:
N#CC1COCC1
Properties
Complexity:
102
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
97.053g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
97.117g/mol
Monoisotopic Mass:
97.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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