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681034-36-6 | Benzoxazole, 2-ethyl-5-(oxiranylmethoxy)- (9CI)
CAS No: 681034-36-6 Catalog No: AG00G1TQ MDL No:
Product Description
Catalog Number:
AG00G1TQ
Chemical Name:
Benzoxazole, 2-ethyl-5-(oxiranylmethoxy)- (9CI)
CAS Number:
681034-36-6
IUPAC Name:
2-ethyl-5-(oxiran-2-ylmethoxy)-1,3-benzoxazole
InChI:
InChI=1S/C12H13NO3/c1-2-12-13-10-5-8(3-4-11(10)16-12)14-6-9-7-15-9/h3-5,9H,2,6-7H2,1H3
InChI Key:
QTTVBJDNOFPCPS-UHFFFAOYSA-N
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.24g/mol
Monoisotopic Mass:
219.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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