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102438-99-3 | Benzenamine, 2,4,6-trimethoxy-, hydrochloride (1:1)
CAS No: 102438-99-3 Catalog No: AG0007HU MDL No:MFCD00211326
Product Description
Catalog Number:
AG0007HU
Chemical Name:
Benzenamine, 2,4,6-trimethoxy-, hydrochloride (1:1)
CAS Number:
102438-99-3
Molecular Formula:
C9H14ClNO3
Molecular Weight:
219.6654
MDL Number:
MFCD00211326
IUPAC Name:
2,4,6-trimethoxyaniline;hydrochloride
InChI:
InChI=1S/C9H13NO3.ClH/c1-11-6-4-7(12-2)9(10)8(5-6)13-3;/h4-5H,10H2,1-3H3;1H
InChI Key:
GRHAUEFIQOUKAY-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c(c(c1)OC)N.Cl
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.066g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
219.665g/mol
Monoisotopic Mass:
219.066g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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