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23593-08-0 | 1H-Imidazole, 2-[(4-chloro-1-naphthalenyl)methyl]-4,5-dihydro-, hydrochloride (1:1)
CAS No: 23593-08-0 Catalog No: AG002NSQ MDL No:
Product Description
Catalog Number:
AG002NSQ
Chemical Name:
1H-Imidazole, 2-[(4-chloro-1-naphthalenyl)methyl]-4,5-dihydro-, hydrochloride (1:1)
CAS Number:
23593-08-0
Molecular Formula:
C14H14Cl2N2
Molecular Weight:
281.1804
IUPAC Name:
2-[(4-chloronaphthalen-1-yl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride
InChI:
InChI=1S/C14H13ClN2.ClH/c15-13-6-5-10(9-14-16-7-8-17-14)11-3-1-2-4-12(11)13;/h1-6H,7-9H2,(H,16,17);1H
InChI Key:
JOJMOKBPTKPWER-UHFFFAOYSA-N
SMILES:
Clc1ccc(c2c1cccc2)CC1=NCCN1.Cl
EC Number:
245-763-2
UNII:
7WVH15JYKM
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.053g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
281.18g/mol
Monoisotopic Mass:
280.053g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
24.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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