3-ethyl-2-methyl-1,3-benzoxazol-3-ium

CAS: 42846-14-0

Molecular Formula	`C10H12NO+`
Molecular Weight	162.21 g/mol
LogP	2.6
Topological Polar Surface Area	17.0 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	1
Rotatable Bonds	1
Exact Mass	162.09189
Heavy Atoms	12
Complexity	160.0

Chemical Identifiers

CAS Number	42846-14-0
SMILES	`CC[N+]1=C(OC2=CC=CC=C21)C`
InChIKey	`PAWXTPSQTMYBSB-UHFFFAOYSA-N`

📖 Product Overview

3-ethyl-2-methyl-1,3-benzoxazol-3-ium (CAS: 42846-14-0) is a chemical compound with molecular formula C10H12NO+ and molecular weight 162.21 g/mol. Its IUPAC systematic name is 3-ethyl-2-methyl-1,3-benzoxazol-3-ium. LogP 2.6 Topological Polar Surface Area 17.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 1 Rotatable Bonds 1 Exact Mass 162.09189 Heavy Atoms 12 Complexity 160.0 InChI Key: PAWXTPSQTMYBSB-UHFFFAOYSA-N. SMILES: CC[N+]1=C(OC2=CC=CC=C21)C.

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