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139525-77-2 | 1-Naphthaleneethanamine, 7-methoxy-, hydrochloride (1:1)
CAS No: 139525-77-2 Catalog No: AG001B6I MDL No:MFCD13185884
Product Description
Catalog Number:
AG001B6I
Chemical Name:
1-Naphthaleneethanamine, 7-methoxy-, hydrochloride (1:1)
CAS Number:
139525-77-2
Molecular Formula:
C13H16ClNO
Molecular Weight:
237.7252
MDL Number:
MFCD13185884
IUPAC Name:
2-(7-methoxynaphthalen-1-yl)ethanamine;hydrochloride
InChI:
InChI=1S/C13H15NO.ClH/c1-15-12-6-5-10-3-2-4-11(7-8-14)13(10)9-12;/h2-6,9H,7-8,14H2,1H3;1H
InChI Key:
HPYGZUDDGWEYDQ-UHFFFAOYSA-N
SMILES:
NCCc1cccc2c1cc(OC)cc2.Cl
EC Number:
604-144-0
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.092g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
237.727g/mol
Monoisotopic Mass:
237.092g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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