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232280-77-2 | 2-Thiophenecarbonitrile, 4-(aminomethyl)-
CAS No: 232280-77-2 Catalog No: AG002ML8 MDL No:MFCD08457572
Product Description
Catalog Number:
AG002ML8
Chemical Name:
2-Thiophenecarbonitrile, 4-(aminomethyl)-
CAS Number:
232280-77-2
Molecular Formula:
C6H6N2S
Molecular Weight:
138.1902
MDL Number:
MFCD08457572
IUPAC Name:
4-(aminomethyl)thiophene-2-carbonitrile
InChI:
InChI=1S/C6H6N2S/c7-2-5-1-6(3-8)9-4-5/h1,4H,2,7H2
InChI Key:
WELJMDZGAZGMIM-UHFFFAOYSA-N
SMILES:
NCc1csc(c1)C#N
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.025g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
138.188g/mol
Monoisotopic Mass:
138.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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