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88108-96-7 | Quinoline, 1,2-dihydro-2,3,4-trimethyl-
CAS No: 88108-96-7 Catalog No: AG004IS9 MDL No:
Product Description
Catalog Number:
AG004IS9
Chemical Name:
Quinoline, 1,2-dihydro-2,3,4-trimethyl-
CAS Number:
88108-96-7
Molecular Formula:
C12H15N
Molecular Weight:
173.2542
IUPAC Name:
2,3,4-trimethyl-1,2-dihydroquinoline
InChI:
InChI=1S/C12H15N/c1-8-9(2)11-6-4-5-7-12(11)13-10(8)3/h4-7,10,13H,1-3H3
InChI Key:
KFHLAQZSZAJKKJ-UHFFFAOYSA-N
SMILES:
CC1=C(C)c2c(NC1C)cccc2
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.12g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.259g/mol
Monoisotopic Mass:
173.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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