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18113-21-8 | Phenol, 2-chloro-3,5-dimethoxy-
CAS No: 18113-21-8 Catalog No: AG0022P7 MDL No:MFCD02114288
Product Description
Catalog Number:
AG0022P7
Chemical Name:
Phenol, 2-chloro-3,5-dimethoxy-
CAS Number:
18113-21-8
Molecular Formula:
C8H9ClO3
Molecular Weight:
188.6083
MDL Number:
MFCD02114288
IUPAC Name:
2-chloro-3,5-dimethoxyphenol
InChI:
InChI=1S/C8H9ClO3/c1-11-5-3-6(10)8(9)7(4-5)12-2/h3-4,10H,1-2H3
InChI Key:
UXZNREKNBHZYIT-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c(c(c1)O)Cl
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.024g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.607g/mol
Monoisotopic Mass:
188.024g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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