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1080060-60-1 | 2-(1,3-dioxolan-2-yl)-1,3-thiazole-5-carbaldehyde
CAS No: 1080060-60-1 Catalog No: AG01BDZE MDL No:MFCD24686876
Product Description
Catalog Number:
AG01BDZE
Chemical Name:
2-(1,3-dioxolan-2-yl)-1,3-thiazole-5-carbaldehyde
CAS Number:
1080060-60-1
Molecular Formula:
C7H7NO3S
Molecular Weight:
185.2004
MDL Number:
MFCD24686876
IUPAC Name:
2-(1,3-dioxolan-2-yl)-1,3-thiazole-5-carbaldehyde
InChI:
InChI=1S/C7H7NO3S/c9-4-5-3-8-6(12-5)7-10-1-2-11-7/h3-4,7H,1-2H2
InChI Key:
IWACAIAPKGVQDE-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(s1)C1OCCO1
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.015g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.197g/mol
Monoisotopic Mass:
185.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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