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21172-88-3 | 2-Chloro-5,6,7,8-tetrahydroquinoline
CAS No: 21172-88-3 Catalog No: AG003A43 MDL No:MFCD09034992
Product Description
Catalog Number:
AG003A43
Chemical Name:
2-Chloro-5,6,7,8-tetrahydroquinoline
CAS Number:
21172-88-3
Molecular Formula:
C9H10ClN
Molecular Weight:
167.6354
MDL Number:
MFCD09034992
IUPAC Name:
2-chloro-5,6,7,8-tetrahydroquinoline
InChI:
InChI=1S/C9H10ClN/c10-9-6-5-7-3-1-2-4-8(7)11-9/h5-6H,1-4H2
InChI Key:
ZUXMRCHYHAWERW-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(n1)CCCC2
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.05g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.636g/mol
Monoisotopic Mass:
167.05g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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