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88408-41-7

88408-41-7 | 1,2-Benzenediol, 4-(2-aminoethyl)-3-chloro-, hydrochloride

CAS No: 88408-41-7 Catalog No: AG004KZ7 MDL No:

Product Description

Catalog Number:
AG004KZ7
Chemical Name:
1,2-Benzenediol, 4-(2-aminoethyl)-3-chloro-, hydrochloride
CAS Number:
88408-41-7
Molecular Formula:
C8H11Cl2NO2
Molecular Weight:
224.0844
IUPAC Name:
4-(2-aminoethyl)-3-chlorobenzene-1,2-diol;hydrochloride
InChI:
InChI=1S/C8H10ClNO2.ClH/c9-7-5(3-4-10)1-2-6(11)8(7)12;/h1-2,11-12H,3-4,10H2;1H
InChI Key:
HOLFEEFAAQJDIA-UHFFFAOYSA-N
SMILES:
NCCc1ccc(c(c1Cl)O)O.Cl

Properties

Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.017g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
224.081g/mol
Monoisotopic Mass:
223.017g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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