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1222781-70-5 | 1-Naphthalenemethanamine, N-[(4-methoxyphenyl)methyl]-, hydrochloride (1:1)
CAS No: 1222781-70-5 Catalog No: AG00170U MDL No:MFCD20921521
Product Description
Catalog Number:
AG00170U
Chemical Name:
1-Naphthalenemethanamine, N-[(4-methoxyphenyl)methyl]-, hydrochloride (1:1)
CAS Number:
1222781-70-5
Molecular Formula:
C19H20ClNO
Molecular Weight:
313.8212
MDL Number:
MFCD20921521
IUPAC Name:
1-(4-methoxyphenyl)-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride
InChI:
InChI=1S/C19H19NO.ClH/c1-21-18-11-9-15(10-12-18)13-20-14-17-7-4-6-16-5-2-3-8-19(16)17;/h2-12,20H,13-14H2,1H3;1H
InChI Key:
NGQIBUUFXDPHKT-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CNCc1cccc2c1cccc2.Cl
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.123g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
313.825g/mol
Monoisotopic Mass:
313.123g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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