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140631-53-4 | 1-Naphthalenamine, 4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-
CAS No: 140631-53-4 Catalog No: AG001CLO MDL No:MFCD06411114
Product Description
Catalog Number:
AG001CLO
Chemical Name:
1-Naphthalenamine, 4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-
CAS Number:
140631-53-4
Molecular Formula:
C17H17Cl2N
Molecular Weight:
306.2296
MDL Number:
MFCD06411114
IUPAC Name:
4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
InChI:
InChI=1S/C17H17Cl2N/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11/h2-6,8,10,12,17,20H,7,9H2,1H3
InChI Key:
VGKDLMBJGBXTGI-UHFFFAOYSA-N
SMILES:
CNC1CCC(c2c1cccc2)c1ccc(c(c1)Cl)Cl
EC Number:
616-709-9
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.074g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
306.23g/mol
Monoisotopic Mass:
305.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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