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937648-96-9 | (2-ethoxy-1,3-thiazol-5-yl)methanol
CAS No: 937648-96-9 Catalog No: AG00JD48 MDL No:MFCD09693784
Product Description
Catalog Number:
AG00JD48
Chemical Name:
(2-ethoxy-1,3-thiazol-5-yl)methanol
CAS Number:
937648-96-9
Molecular Formula:
C6H9NO2S
Molecular Weight:
159.2062
MDL Number:
MFCD09693784
IUPAC Name:
(2-ethoxy-1,3-thiazol-5-yl)methanol
InChI:
InChI=1S/C6H9NO2S/c1-2-9-6-7-3-5(4-8)10-6/h3,8H,2,4H2,1H3
InChI Key:
FDGAQIGCOKUYBM-UHFFFAOYSA-N
SMILES:
CCOc1ncc(s1)CO
Properties
Complexity:
102
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.035g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.203g/mol
Monoisotopic Mass:
159.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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