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1219531-56-2 | Thieno[3,4-c]pyridine, 1-bromo-4,5,6,7-tetrahydro-
CAS No: 1219531-56-2 Catalog No: AG0016G9 MDL No:MFCD17215801
Product Description
Catalog Number:
AG0016G9
Chemical Name:
Thieno[3,4-c]pyridine, 1-bromo-4,5,6,7-tetrahydro-
CAS Number:
1219531-56-2
Molecular Formula:
C7H8BrNS
Molecular Weight:
218.1141
MDL Number:
MFCD17215801
IUPAC Name:
1-bromo-4,5,6,7-tetrahydrothieno[3,4-c]pyridine
InChI:
InChI=1S/C7H8BrNS/c8-7-6-1-2-9-3-5(6)4-10-7/h4,9H,1-3H2
InChI Key:
XRGUCVYYQLZQPV-UHFFFAOYSA-N
SMILES:
Brc1scc2c1CCNC2
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.956g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.112g/mol
Monoisotopic Mass:
216.956g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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