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101819-99-2 | Phenol, 6-amino-2,4-dichloro-3-ethyl-, hydrochloride (1:1)
CAS No: 101819-99-2 Catalog No: AG0005MV MDL No:MFCD00270793
Product Description
Catalog Number:
AG0005MV
Chemical Name:
Phenol, 6-amino-2,4-dichloro-3-ethyl-, hydrochloride (1:1)
CAS Number:
101819-99-2
Molecular Formula:
C8H10Cl3NO
Molecular Weight:
242.5301
MDL Number:
MFCD00270793
IUPAC Name:
6-amino-2,4-dichloro-3-ethylphenol;hydrochloride
InChI:
InChI=1S/C8H9Cl2NO.ClH/c1-2-4-5(9)3-6(11)8(12)7(4)10;/h3,12H,2,11H2,1H3;1H
InChI Key:
XZZITYVICUAZNB-UHFFFAOYSA-N
SMILES:
CCc1c(Cl)cc(c(c1Cl)O)N.Cl
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.983g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
242.524g/mol
Monoisotopic Mass:
240.983g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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