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13330-15-9 | Benzenamine, N,N,4-trimethyl-, hydrochloride (1:1)
CAS No: 13330-15-9 Catalog No: AG0014L2 MDL No:
Product Description
Catalog Number:
AG0014L2
Chemical Name:
Benzenamine, N,N,4-trimethyl-, hydrochloride (1:1)
CAS Number:
13330-15-9
Molecular Formula:
C9H14ClN
Molecular Weight:
171.6672
IUPAC Name:
N,N,4-trimethylaniline;hydrochloride
InChI:
InChI=1S/C9H13N.ClH/c1-8-4-6-9(7-5-8)10(2)3;/h4-7H,1-3H3;1H
InChI Key:
MSWANEMFQROHCW-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)N(C)C.Cl
Properties
Complexity:
90.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.081g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.668g/mol
Monoisotopic Mass:
171.081g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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