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2060034-98-0 | 2-[(2-bromophenyl)methyl]pyridine-3-carbaldehyde
CAS No: 2060034-98-0 Catalog No: AG01BVYF MDL No:MFCD30476588
Product Description
Catalog Number:
AG01BVYF
Chemical Name:
2-[(2-bromophenyl)methyl]pyridine-3-carbaldehyde
CAS Number:
2060034-98-0
Molecular Formula:
C13H10BrNO
Molecular Weight:
276.1286
MDL Number:
MFCD30476588
IUPAC Name:
2-[(2-bromophenyl)methyl]pyridine-3-carbaldehyde
InChI:
InChI=1S/C13H10BrNO/c14-12-6-2-1-4-10(12)8-13-11(9-16)5-3-7-15-13/h1-7,9H,8H2
InChI Key:
DWQAQHDUQNHXSB-UHFFFAOYSA-N
SMILES:
O=Cc1cccnc1Cc1ccccc1Br
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.995g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.133g/mol
Monoisotopic Mass:
274.995g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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