AG0037D6

61548-83-2 | tert-Butyl n-dodecyl ether

AG0037D6

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CAS Number	61548-83-2
Catalog Number	AG0037D6(AGN-PC-0NIDBZ)
Chemical Name	tert-Butyl n-dodecyl ether
IUPAC Name	1-[(2-methylpropan-2-yl)oxy]dodecane
InChI	InChI=1S/C16H34O/c1-5-6-7-8-9-10-11-12-13-14-15-17-16(2,3)4/h5-15H2,1-4H3
InChI Key	ZPGDKUJNUNOUME-UHFFFAOYSA-N
MDL Number	MFCD31807280
Molecular Formula	C16H34O
Molecular Weight	242.4406
SMILES	CC(C)(OCCCCCCCCCCCC)C
Synonyms	tert-Butyl n-dodecyl ether, 61548-83-2, Dodecane, 1-(1,1-dimethylethoxy)-, SCHEMBL4501236, CTK2D7692, DTXSID50484432,

Complexity	146
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.261g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	242.447g/mol
Monoisotopic Mass	242.261g/mol
Rotatable Bond Count	12
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code	\N

Certificate of Analysis

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