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Home > Aldehydes > 1259480-32-4
1259480-32-4 | 5-BROMO-2-MERCAPTOBENZALDEHYDE
CAS No: 1259480-32-4 Catalog No: AG01BKJF MDL No:MFCD12756623
Product Description
Catalog Number:
AG01BKJF
Chemical Name:
5-BROMO-2-MERCAPTOBENZALDEHYDE
CAS Number:
1259480-32-4
Molecular Formula:
C7H5BrOS
Molecular Weight:
217.0830
MDL Number:
MFCD12756623
IUPAC Name:
5-bromo-2-sulfanylbenzaldehyde
InChI:
InChI=1S/C7H5BrOS/c8-6-1-2-7(10)5(3-6)4-9/h1-4,10H
InChI Key:
MDPXRAGTVDFRMD-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Br)ccc1S
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.924g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.08g/mol
Monoisotopic Mass:
215.924g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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