AG0099TS

1207175-03-8 | tert-Butyl 2-(oxetan-3-ylidene)acetate

AG0099TS

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CAS Number	1207175-03-8
Catalog Number	AG0099TS(AGN-PC-0WBRLS)
Chemical Name	tert-Butyl 2-(oxetan-3-ylidene)acetate
IUPAC Name	tert-butyl 2-(oxetan-3-ylidene)acetate
InChI	InChI=1S/C9H14O3/c1-9(2,3)12-8(10)4-7-5-11-6-7/h4H,5-6H2,1-3H3
InChI Key	ARJYDTSMXYEQSN-UHFFFAOYSA-N
MDL Number	MFCD14586412
Molecular Formula	C9H14O3
Molecular Weight	170.2057
SMILES	CC(OC(/C=C1COC1)=O)(C)C
Synonyms	TERT-BUTYL 2-(OXETAN-3-YLIDENE)ACETATE, 1207175-03-8, tert-Butyl 3-oxetanylideneacetate, KS-000007AK, MFCD14586412, ZINC45028282, AKOS006336768, PB19405, AS-32693, DB-057965, CS-0048454, FT-0734087, Q-1797, A1-11799,

Complexity	204
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.094g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	170.208g/mol
Monoisotopic Mass	170.094g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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