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277331-17-6 | Benzenemethanol, 2-chloro-3-hydroxy-
CAS No: 277331-17-6 Catalog No: AG002UMD MDL No:
Product Description
Catalog Number:
AG002UMD
Chemical Name:
Benzenemethanol, 2-chloro-3-hydroxy-
CAS Number:
277331-17-6
Molecular Formula:
C7H7ClO2
Molecular Weight:
158.5823
IUPAC Name:
2-chloro-3-(hydroxymethyl)phenol
InChI:
InChI=1S/C7H7ClO2/c8-7-5(4-9)2-1-3-6(7)10/h1-3,9-10H,4H2
InChI Key:
VFCYCVIHXKLLNX-UHFFFAOYSA-N
SMILES:
OCc1cccc(c1Cl)O
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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