Home Nitriles 2-Thiophenecarbonitrile, 5-(1-hydroxyethyl)- (9CI)

2-Thiophenecarbonitrile, 5-(1-hydroxyethyl)- (9CI)

CAS No.:
353282-69-6
Catalog Number:
AG00D56M
Molecular Formula:
C7H7NOS
Molecular Weight:
153.2016
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Product Description
Catalog Number:
AG00D56M
Chemical Name:
2-Thiophenecarbonitrile, 5-(1-hydroxyethyl)- (9CI)
CAS Number:
353282-69-6
Molecular Formula:
C7H7NOS
Molecular Weight:
153.2016
MDL Number:
MFCD18817083
IUPAC Name:
5-(1-hydroxyethyl)thiophene-2-carbonitrile
InChI:
InChI=1S/C7H7NOS/c1-5(9)7-3-2-6(4-8)10-7/h2-3,5,9H,1H3
InChI Key:
IGCHXOJQJCMNQS-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(s1)C(O)C
Properties
Complexity:
162  
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:
1  
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties