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16237-62-0 | 2-Furanpropanenitrile, tetrahydro-
CAS No: 16237-62-0 Catalog No: AG001T22 MDL No:
Product Description
Catalog Number:
AG001T22
Chemical Name:
2-Furanpropanenitrile, tetrahydro-
CAS Number:
16237-62-0
Molecular Formula:
C7H11NO
Molecular Weight:
125.1683
IUPAC Name:
3-(oxolan-2-yl)propanenitrile
InChI:
InChI=1S/C7H11NO/c8-5-1-3-7-4-2-6-9-7/h7H,1-4,6H2
InChI Key:
JBHAZBKWNJJBJZ-UHFFFAOYSA-N
SMILES:
N#CCCC1CCCO1
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
125.171g/mol
Monoisotopic Mass:
125.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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