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135510-61-1 | 2-Propen-1-ol,3-(3,5-dimethyl-4-isoxazolyl)-(9CI)
CAS No: 135510-61-1 Catalog No: AG00A8P2 MDL No:
Product Description
Catalog Number:
AG00A8P2
Chemical Name:
2-Propen-1-ol,3-(3,5-dimethyl-4-isoxazolyl)-(9CI)
CAS Number:
135510-61-1
IUPAC Name:
(E)-3-(3,5-dimethyl-1,2-oxazol-4-yl)prop-2-en-1-ol
InChI:
InChI=1S/C8H11NO2/c1-6-8(4-3-5-10)7(2)11-9-6/h3-4,10H,5H2,1-2H3/b4-3+
InChI Key:
MWXHDNLJGDCKAI-ONEGZZNKSA-N
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
153.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
153.181g/mol
Monoisotopic Mass:
153.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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