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Home > Aldehydes > 125872-43-7
125872-43-7 | 7-Benzothiazolecarboxaldehyde,2-methyl-(9CI)
CAS No: 125872-43-7 Catalog No: AG00A3U4 MDL No:
Product Description
Catalog Number:
AG00A3U4
Chemical Name:
7-Benzothiazolecarboxaldehyde,2-methyl-(9CI)
CAS Number:
125872-43-7
IUPAC Name:
2-methyl-1,3-benzothiazole-7-carbaldehyde
InChI:
InChI=1S/C9H7NOS/c1-6-10-8-4-2-3-7(5-11)9(8)12-6/h2-5H,1H3
InChI Key:
ONDKHNPTMVQBTF-UHFFFAOYSA-N
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.025g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.221g/mol
Monoisotopic Mass:
177.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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