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1379334-15-2 | 2-(5-Chloro-2-thienyl)-2-butanol
CAS No: 1379334-15-2 Catalog No: AG01FEOQ MDL No:
Product Description
Catalog Number:
AG01FEOQ
Chemical Name:
2-(5-Chloro-2-thienyl)-2-butanol
CAS Number:
1379334-15-2
Molecular Formula:
C8H11ClOS
Molecular Weight:
190.6903
IUPAC Name:
2-(5-chlorothiophen-2-yl)butan-2-ol
InChI:
InChI=1S/C8H11ClOS/c1-3-8(2,10)6-4-5-7(9)11-6/h4-5,10H,3H2,1-2H3
InChI Key:
FEKKDCGUZXJABQ-UHFFFAOYSA-N
SMILES:
CC(c1ccc(s1)Cl)(CC)O
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.022g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.685g/mol
Monoisotopic Mass:
190.022g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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