AG00DER3

52287-51-1 | 6-Bromo-1,4-benzodioxane

AG00DER3

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CAS Number	52287-51-1
Catalog Number	AG00DER3(AGN-PC-0JLE5P)
Chemical Name	6-Bromo-1,4-benzodioxane
EC Number	257-817-2
IUPAC Name	6-bromo-2,3-dihydro-1,4-benzodioxine
InChI	InChI=1S/C8H7BrO2/c9-6-1-2-7-8(5-6)11-4-3-10-7/h1-2,5H,3-4H2
InChI Key	LFCURAJBHDNUNG-UHFFFAOYSA-N
MDL Number	MFCD00040750
Molecular Formula	C8H7BrO2
Molecular Weight	215.0440
SMILES	c12c(ccc(c1)Br)OCCO2
Synonyms	52287-51-1, 6-Bromo-1,4-benzodioxane, 6-bromo-2,3-dihydrobenzo[b][1,4]dioxine, 3,4-Ethylenedioxybromobenzene, 6-bromo-2,3-dihydro-1,4-benzodioxine, 6-Bromo-2,3-dihydro-1,4-benzodioxin, 1,4-Benzodioxin, 6-bromo-2,3-dihydro-, 4-Bromo-1,2-ethylenedioxybenzene, LFCURAJBHDNUNG-UHFFFAOYSA-N, 6-Bromo-1,4-benzodioxane, 97%, 3,4-ETHYLENDIOXYBROMOBENZENE, MFCD00040750, 6-BROMO-2,3-DIHYDRO-BENZO[1,4]DIOXINE, EINECS 257-817-2, PubChem3736, ACMC-209kyk, 6-Bromo-1,4-benzodioxan, AC1Q1H9W, SCHEMBL661042, AC1L2W70, AC1Q259X, CTK4J5713, KS-00000FHH, LFCURAJBHDNUNG-UHFFFAOYSA-, TIMTEC-BB SBB003399, DTXSID90200310, BUTTPARK 95\50-63, HMS1747I15, ACT03923, BCP23326, ZINC4208942, 1-bromo-3,4-(ethylenedioxy)benzene, 4-Bromo-1,2-(ethylenedioxy)benzene, ANW-31434, CB-887, CB0154, SBB003399, STK661552, 6-bromo-2H,3H-benzo[e]1,4-dioxin, AKOS000202447, 6-bromo-2H,3H-benzo[e]1,4-dioxane, AB01820, AS00921, CS-W002191, DS-1886, MCULE-5572946220, PS-4345, VZ30655, 6-bromo-2,3-dihydrobenzo[1,4]dioxine, 7-bromo-2,3-dihydro-1,4-benzodioxine, 1,4-Benzodioxin,6-bromo-2,3-dihydro-, AJ-48930, AK-39056, BC002542, CJ-11568, EN000659, QC-10757, SC-05023, SY014054, 6-bromo-2,3-dihydro-benzo[1,4] dioxine, AB0025276, AB1010168, DB-002114, ST4147610, TC-010390, AM20040622, B2351, ST24029641, W6709, MFCD00040750 (98%), Q-7057, I14-0846, Q-103549, InChI=1/C8H7BrO2/c9-6-1-2-7-8(5-6)11-4-3-10-7/h1-2,5H,3-4H2, null, C8H7BrO2, C8-H7-Br-O2, AR-1H1043, CID104141, ZINC04208942, ACN-040373, 5333-90-4,

Complexity	140
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.963g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	215.046g/mol
Monoisotopic Mass	213.963g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number