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1443328-54-8 | 4-Chloro-3-methylphenyl-(3-furyl)methanol
CAS No: 1443328-54-8 Catalog No: AG01FBNR MDL No:
Product Description
Catalog Number:
AG01FBNR
Chemical Name:
4-Chloro-3-methylphenyl-(3-furyl)methanol
CAS Number:
1443328-54-8
Molecular Formula:
C12H11ClO2
Molecular Weight:
222.6675
IUPAC Name:
(4-chloro-3-methylphenyl)-(furan-3-yl)methanol
InChI:
InChI=1S/C12H11ClO2/c1-8-6-9(2-3-11(8)13)12(14)10-4-5-15-7-10/h2-7,12,14H,1H3
InChI Key:
KMFCSWMJHUUMDH-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1C)C(c1cocc1)O
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.045g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.668g/mol
Monoisotopic Mass:
222.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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