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68845-34-1 | N-PHENYL-N-(2,4,4-TRIMETHYLPENTYL)NAPHTHALEN-2-AMINE
CAS No: 68845-34-1 Catalog No: AG006GHK MDL No:
Product Description
Catalog Number:
AG006GHK
Chemical Name:
N-PHENYL-N-(2,4,4-TRIMETHYLPENTYL)NAPHTHALEN-2-AMINE
CAS Number:
68845-34-1
Molecular Formula:
C24H29N
Molecular Weight:
331.4938
IUPAC Name:
N-phenyl-N-(2,4,4-trimethylpentyl)naphthalen-2-amine
InChI:
InChI=1S/C24H29N/c1-19(17-24(2,3)4)18-25(22-12-6-5-7-13-22)23-15-14-20-10-8-9-11-21(20)16-23/h5-16,19H,17-18H2,1-4H3
InChI Key:
NOSNNQQNOPZHMH-UHFFFAOYSA-N
SMILES:
CC(CC(C)(C)C)CN(c1ccc2c(c1)cccc2)c1ccccc1
EC Number:
272-460-2
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.23g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.503g/mol
Monoisotopic Mass:
331.23g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
7.7
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