AG002VTX

286-22-6 | 3,7-dioxabicyclo[4.1.0]heptane

AG002VTX

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CAS Number	286-22-6
Catalog Number	AG002VTX(AGN-PC-0031GK)
Chemical Name	3,7-dioxabicyclo[4.1.0]heptane
IUPAC Name	3,7-dioxabicyclo[4.1.0]heptane
InChI	InChI=1S/C5H8O2/c1-2-6-3-5-4(1)7-5/h4-5H,1-3H2
InChI Key	XGDSKVZBNGTARC-UHFFFAOYSA-N
MDL Number	MFCD11226853
Molecular Formula	C5H8O2
Molecular Weight	100.1158
SMILES	C12COCCC1O2
Synonyms	3,7-dioxabicyclo[4.1.0]heptane, 286-22-6, 3,4-epoxytetrahydropyran, 4,7-dioxabicyclo[4.1.0]heptane, AC1Q1HBJ, SCHEMBL1313014, (+/-)3,4-epoxytetrahydropyran, CTK0J1929, DTXSID30475944, XGDSKVZBNGTARC-UHFFFAOYSA-N, 3,7-dioxa-bicyclo[4.1.0]heptane, MFCD11226853, SBB085147, AKOS005260020, ACN-051254, NE26654, SB11791, KS-000004I4, BS-12726, SC-69496, SY098970, CS-0051589, EN300-68902, MFCD11226853 (95%), (1SR,6RS)-3,7-dioxabicyclo[4.1.0]heptane,

Complexity	82.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	100.052g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	100.117g/mol
Monoisotopic Mass	100.052g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	21.8A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H225
Packing Group	Ⅲ
Precautionary statements	P210-P273-P243-P403
UN Code	UN 1993

Certificate of Analysis

Lot Number