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1263374-32-8 | 2H-Pyran-4-carbonitrile, 4-(aminomethyl)tetrahydro-
CAS No: 1263374-32-8 Catalog No: AG000SNV MDL No:MFCD26406716
Product Description
Catalog Number:
AG000SNV
Chemical Name:
2H-Pyran-4-carbonitrile, 4-(aminomethyl)tetrahydro-
CAS Number:
1263374-32-8
Molecular Formula:
C7H12N2O
Molecular Weight:
140.1830
MDL Number:
MFCD26406716
IUPAC Name:
4-(aminomethyl)oxane-4-carbonitrile
InChI:
InChI=1S/C7H12N2O/c8-5-7(6-9)1-3-10-4-2-7/h1-5,8H2
InChI Key:
WRAFVYHNHMNOCQ-UHFFFAOYSA-N
SMILES:
NCC1(CCOCC1)C#N
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.095g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
140.186g/mol
Monoisotopic Mass:
140.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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