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209741-69-5 | Phenol, 5-amino-2,3-dimethoxy-
CAS No: 209741-69-5 Catalog No: AG002KE3 MDL No:
Product Description
Catalog Number:
AG002KE3
Chemical Name:
Phenol, 5-amino-2,3-dimethoxy-
CAS Number:
209741-69-5
Molecular Formula:
C8H11NO3
Molecular Weight:
169.1778
IUPAC Name:
5-amino-2,3-dimethoxyphenol
InChI:
InChI=1S/C8H11NO3/c1-11-7-4-5(9)3-6(10)8(7)12-2/h3-4,10H,9H2,1-2H3
InChI Key:
XYHAVIGAXZDXRF-UHFFFAOYSA-N
SMILES:
COc1cc(N)cc(c1OC)O
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
169.18g/mol
Monoisotopic Mass:
169.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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