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1333222-43-7 | 2-Thiophenecarbonitrile, 5-(2-hydroxyethyl)-
CAS No: 1333222-43-7 Catalog No: AG0014MQ MDL No:
Product Description
Catalog Number:
AG0014MQ
Chemical Name:
2-Thiophenecarbonitrile, 5-(2-hydroxyethyl)-
CAS Number:
1333222-43-7
Molecular Formula:
C7H7NOS
Molecular Weight:
153.2016
IUPAC Name:
5-(2-hydroxyethyl)thiophene-2-carbonitrile
InChI:
InChI=1S/C7H7NOS/c8-5-7-2-1-6(10-7)3-4-9/h1-2,9H,3-4H2
InChI Key:
SQMLAGVIZKTNSF-UHFFFAOYSA-N
SMILES:
OCCc1ccc(s1)C#N
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.025g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
153.199g/mol
Monoisotopic Mass:
153.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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