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1250342-63-2 | 2-(2-methoxyethyl)-1,3-thiazole-5-carbaldehyde
CAS No: 1250342-63-2 Catalog No: AG01A1GC MDL No:MFCD14661568
Product Description
Catalog Number:
AG01A1GC
Chemical Name:
2-(2-methoxyethyl)-1,3-thiazole-5-carbaldehyde
CAS Number:
1250342-63-2
Molecular Formula:
C7H9NO2S
Molecular Weight:
171.2169
MDL Number:
MFCD14661568
IUPAC Name:
2-(2-methoxyethyl)-1,3-thiazole-5-carbaldehyde
InChI:
InChI=1S/C7H9NO2S/c1-10-3-2-7-8-4-6(5-9)11-7/h4-5H,2-3H2,1H3
InChI Key:
IRFCUKUJUQVMCI-UHFFFAOYSA-N
SMILES:
COCCc1ncc(s1)C=O
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.035g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.214g/mol
Monoisotopic Mass:
171.035g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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