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19219-98-8 | Benzoxazole, 2,5,6-trimethyl-
CAS No: 19219-98-8 Catalog No: AG002FQ2 MDL No:MFCD00022849
Product Description
Catalog Number:
AG002FQ2
Chemical Name:
Benzoxazole, 2,5,6-trimethyl-
CAS Number:
19219-98-8
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
MDL Number:
MFCD00022849
IUPAC Name:
2,5,6-trimethyl-1,3-benzoxazole
InChI:
InChI=1S/C10H11NO/c1-6-4-9-10(5-7(6)2)12-8(3)11-9/h4-5H,1-3H3
InChI Key:
PDVDINPEWGXOHX-UHFFFAOYSA-N
SMILES:
Cc1oc2c(n1)cc(c(c2)C)C
EC Number:
242-887-9
UNII:
OW17OD04B8
NSC Number:
73186
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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