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4849-12-1 | Benzenemethanol, 3,6-dichloro-2-methoxy-
CAS No: 4849-12-1 Catalog No: AG00I8SC MDL No:
Product Description
Catalog Number:
AG00I8SC
Chemical Name:
Benzenemethanol, 3,6-dichloro-2-methoxy-
CAS Number:
4849-12-1
Molecular Formula:
C8H8Cl2O2
Molecular Weight:
207.0539
IUPAC Name:
(3,6-dichloro-2-methoxyphenyl)methanol
InChI:
InChI=1S/C8H8Cl2O2/c1-12-8-5(4-11)6(9)2-3-7(8)10/h2-3,11H,4H2,1H3
InChI Key:
ALPTWNJSENXENZ-UHFFFAOYSA-N
SMILES:
COc1c(Cl)ccc(c1CO)Cl
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.99g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.05g/mol
Monoisotopic Mass:
205.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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