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198134-83-7 | Phenol, 4-amino-2,6-dimethoxy-, hydrochloride (1:1)
CAS No: 198134-83-7 Catalog No: AG002BBG MDL No:
Product Description
Catalog Number:
AG002BBG
Chemical Name:
Phenol, 4-amino-2,6-dimethoxy-, hydrochloride (1:1)
CAS Number:
198134-83-7
Molecular Formula:
C8H12ClNO3
Molecular Weight:
205.6388
IUPAC Name:
4-amino-2,6-dimethoxyphenol;hydrochloride
InChI:
InChI=1S/C8H11NO3.ClH/c1-11-6-3-5(9)4-7(12-2)8(6)10;/h3-4,10H,9H2,1-2H3;1H
InChI Key:
CNDNENQTAKXLHX-UHFFFAOYSA-N
SMILES:
COc1cc(N)cc(c1O)OC.Cl
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.051g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
205.638g/mol
Monoisotopic Mass:
205.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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