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1261598-26-8 | Benzenemethanol, 4-chloro-3-hydroxy-
CAS No: 1261598-26-8 Catalog No: AG000RVL MDL No:MFCD18393156
Product Description
Catalog Number:
AG000RVL
Chemical Name:
Benzenemethanol, 4-chloro-3-hydroxy-
CAS Number:
1261598-26-8
Molecular Formula:
C7H7ClO2
Molecular Weight:
158.5823
MDL Number:
MFCD18393156
IUPAC Name:
2-chloro-5-(hydroxymethyl)phenol
InChI:
InChI=1S/C7H7ClO2/c8-6-2-1-5(4-9)3-7(6)10/h1-3,9-10H,4H2
InChI Key:
ITKUBFQRQGBYTB-UHFFFAOYSA-N
SMILES:
OCc1ccc(c(c1)O)Cl
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.013g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
158.581g/mol
Monoisotopic Mass:
158.013g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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