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22990-31-4 | Quinoline, 4-(1,1-dimethylethyl)-1,2,3,4-tetrahydro-
CAS No: 22990-31-4 Catalog No: AG002LS0 MDL No:MFCD20674198
Product Description
Catalog Number:
AG002LS0
Chemical Name:
Quinoline, 4-(1,1-dimethylethyl)-1,2,3,4-tetrahydro-
CAS Number:
22990-31-4
Molecular Formula:
C13H19N
Molecular Weight:
189.2967
MDL Number:
MFCD20674198
IUPAC Name:
4-tert-butyl-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C13H19N/c1-13(2,3)11-8-9-14-12-7-5-4-6-10(11)12/h4-7,11,14H,8-9H2,1-3H3
InChI Key:
VZIYLFZRSTVWAJ-UHFFFAOYSA-N
SMILES:
CC(C1CCNc2c1cccc2)(C)C
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.152g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.302g/mol
Monoisotopic Mass:
189.152g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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