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1249949-36-7 | 2-Chloro-5-thienyl-(3-furyl)methanol
CAS No: 1249949-36-7 Catalog No: AG01FDGE MDL No:
Product Description
Catalog Number:
AG01FDGE
Chemical Name:
2-Chloro-5-thienyl-(3-furyl)methanol
CAS Number:
1249949-36-7
Molecular Formula:
C9H7ClO2S
Molecular Weight:
214.6687
IUPAC Name:
(2-chlorofuran-3-yl)-thiophen-2-ylmethanol
InChI:
InChI=1S/C9H7ClO2S/c10-9-6(3-4-12-9)8(11)7-2-1-5-13-7/h1-5,8,11H
InChI Key:
ZHXDBVRBSWEHPI-UHFFFAOYSA-N
SMILES:
Clc1ccc(s1)C(c1cocc1)O
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.986g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.663g/mol
Monoisotopic Mass:
213.986g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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