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76916-51-3 | 2-Propyl-1,2,3,4-tetrahydro-quinoline
CAS No: 76916-51-3 Catalog No: AG00GGOB MDL No:MFCD21115152
Product Description
Catalog Number:
AG00GGOB
Chemical Name:
2-Propyl-1,2,3,4-tetrahydro-quinoline
CAS Number:
76916-51-3
Molecular Formula:
C12H17N
Molecular Weight:
175.2701
MDL Number:
MFCD21115152
IUPAC Name:
2-propyl-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C12H17N/c1-2-5-11-9-8-10-6-3-4-7-12(10)13-11/h3-4,6-7,11,13H,2,5,8-9H2,1H3
InChI Key:
RTQBHSJQNWVSGE-UHFFFAOYSA-N
SMILES:
CCCC1CCc2c(N1)cccc2
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.136g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.275g/mol
Monoisotopic Mass:
175.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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