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126910-02-9 | Phenol, 2-amino-3,5-dimethyl-, hydrochloride (1:1)
CAS No: 126910-02-9 Catalog No: AG000TG2 MDL No:
Product Description
Catalog Number:
AG000TG2
Chemical Name:
Phenol, 2-amino-3,5-dimethyl-, hydrochloride (1:1)
CAS Number:
126910-02-9
Molecular Formula:
C8H12ClNO
Molecular Weight:
173.6400
IUPAC Name:
2-amino-3,5-dimethylphenol;hydrochloride
InChI:
InChI=1S/C8H11NO.ClH/c1-5-3-6(2)8(9)7(10)4-5;/h3-4,10H,9H2,1-2H3;1H
InChI Key:
CYAZIZMNLBGMRP-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1)O)N.Cl
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.061g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
173.64g/mol
Monoisotopic Mass:
173.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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