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90731-56-9 | 4-Methyl-5-thiazolylethyl formate
CAS No: 90731-56-9 Catalog No: AG00H1CZ MDL No:MFCD23701666
Product Description
Catalog Number:
AG00H1CZ
Chemical Name:
4-Methyl-5-thiazolylethyl formate
CAS Number:
90731-56-9
Molecular Formula:
C7H9NO2S
Molecular Weight:
171.2169
MDL Number:
MFCD23701666
IUPAC Name:
2-(4-methyl-1,3-thiazol-5-yl)ethyl formate
InChI:
InChI=1S/C7H9NO2S/c1-6-7(11-4-8-6)2-3-10-5-9/h4-5H,2-3H2,1H3
InChI Key:
MONFGMLYTMEKTC-UHFFFAOYSA-N
SMILES:
O=COCCc1scnc1C
UNII:
64NY5Q2QR9
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:
1.4
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