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114744-50-2 | Quinoline, 5-bromo-1,2,3,4-tetrahydro-
CAS No: 114744-50-2 Catalog No: AG000F53 MDL No:MFCD08544260
Product Description
Catalog Number:
AG000F53
Chemical Name:
Quinoline, 5-bromo-1,2,3,4-tetrahydro-
CAS Number:
114744-50-2
Molecular Formula:
C9H10BrN
Molecular Weight:
212.0864
MDL Number:
MFCD08544260
IUPAC Name:
5-bromo-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C9H10BrN/c10-8-4-1-5-9-7(8)3-2-6-11-9/h1,4-5,11H,2-3,6H2
InChI Key:
WTZQIKXLRRDMCP-UHFFFAOYSA-N
SMILES:
Brc1cccc2c1CCCN2
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.09g/mol
Monoisotopic Mass:
211g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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