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832697-59-3 | Thieno[3,2-c]pyridine, 3-bromo-7-(bromomethyl)-4-chloro-
CAS No: 832697-59-3 Catalog No: AG004TUO MDL No:
Product Description
Catalog Number:
AG004TUO
Chemical Name:
Thieno[3,2-c]pyridine, 3-bromo-7-(bromomethyl)-4-chloro-
CAS Number:
832697-59-3
Molecular Formula:
C8H4Br2ClNS
Molecular Weight:
341.4501
IUPAC Name:
3-bromo-7-(bromomethyl)-4-chlorothieno[3,2-c]pyridine
InChI:
InChI=1S/C8H4Br2ClNS/c9-1-4-2-12-8(11)6-5(10)3-13-7(4)6/h2-3H,1H2
InChI Key:
XKCRSWNAEVDPRJ-UHFFFAOYSA-N
SMILES:
BrCc1cnc(c2c1scc2Br)Cl
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.81g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.445g/mol
Monoisotopic Mass:
338.812g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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