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2492-83-3 | Benzeneethanamine, 4-chloro-, hydrochloride (1:1)
CAS No: 2492-83-3 Catalog No: AG002PVV MDL No:MFCD06738863
Product Description
Catalog Number:
AG002PVV
Chemical Name:
Benzeneethanamine, 4-chloro-, hydrochloride (1:1)
CAS Number:
2492-83-3
Molecular Formula:
C8H11Cl2N
Molecular Weight:
192.0856
MDL Number:
MFCD06738863
IUPAC Name:
2-(4-chlorophenyl)ethanamine;hydrochloride
InChI:
InChI=1S/C8H10ClN.ClH/c9-8-3-1-7(2-4-8)5-6-10;/h1-4H,5-6,10H2;1H
InChI Key:
RAQLDEHFRPTIHW-UHFFFAOYSA-N
SMILES:
NCCc1ccc(cc1)Cl.Cl
NSC Number:
93691
Properties
Complexity:
87.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.027g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.083g/mol
Monoisotopic Mass:
191.027g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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