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885272-71-9 | [2-(3-ETHYL-PHENYL)-OXAZOL-4-YL]-METHANOL
CAS No: 885272-71-9 Catalog No: AG00GS3G MDL No:MFCD06738573
Product Description
Catalog Number:
AG00GS3G
Chemical Name:
[2-(3-ETHYL-PHENYL)-OXAZOL-4-YL]-METHANOL
CAS Number:
885272-71-9
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
MDL Number:
MFCD06738573
IUPAC Name:
[2-(3-ethylphenyl)-1,3-oxazol-4-yl]methanol
InChI:
InChI=1S/C12H13NO2/c1-2-9-4-3-5-10(6-9)12-13-11(7-14)8-15-12/h3-6,8,14H,2,7H2,1H3
InChI Key:
DTPLNUJUGVKXNO-UHFFFAOYSA-N
SMILES:
CCc1cccc(c1)c1occ(n1)CO
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.241g/mol
Monoisotopic Mass:
203.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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