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1342663-29-9 | 4-(1,2,3,6-tetrahydropyridin-4-yl)isoquinoline
CAS No: 1342663-29-9 Catalog No: AG01AEWZ MDL No:MFCD19610253
Product Description
Catalog Number:
AG01AEWZ
Chemical Name:
4-(1,2,3,6-tetrahydropyridin-4-yl)isoquinoline
CAS Number:
1342663-29-9
Molecular Formula:
C14H14N2
Molecular Weight:
210.2744
MDL Number:
MFCD19610253
IUPAC Name:
4-(1,2,3,6-tetrahydropyridin-4-yl)isoquinoline
InChI:
InChI=1S/C14H14N2/c1-2-4-13-12(3-1)9-16-10-14(13)11-5-7-15-8-6-11/h1-5,9-10,15H,6-8H2
InChI Key:
RTMAOTZUQASTNC-UHFFFAOYSA-N
SMILES:
N1CCC(=CC1)c1cncc2c1cccc2
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.116g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.28g/mol
Monoisotopic Mass:
210.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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