AG002N01

233770-05-3 | 1-Bromo-2-chloro-4,5-methylenedioxybenzene

AG002N01

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CAS Number	233770-05-3
Catalog Number	AG002N01(AGN-PC-0A8YZE)
Chemical Name	1-Bromo-2-chloro-4,5-methylenedioxybenzene
IUPAC Name	5-bromo-6-chloro-1,3-benzodioxole
InChI	InChI=1S/C7H4BrClO2/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-2H,3H2
InChI Key	VNFIRXCKAFPWRQ-UHFFFAOYSA-N
MDL Number	MFCD12547818
Molecular Formula	C7H4BrClO2
Molecular Weight	235.4625
SMILES	ClC1=C(Br)C=C2OCOC2=C1
Synonyms	233770-05-3, 5-Bromo-6-chlorobenzo[d][1,3]dioxole, 1-Bromo-2-chloro-4,5-methylenedioxybenzene, ACMC-209g2t, SCHEMBL8524080, CTK8B1261, DTXSID30711091, 5-bromo-6-chloro-1,3-benzodioxole, ANW-25107, MFCD12547818, ZINC40571506, AKOS015888560, FCH1414996, 1,3-Benzodioxole, 5-bromo-6-chloro-, 5-Bromo-6-chloro-2H-1,3-benzodioxole, AK-98587, DS-18653, AJ-103700, AX8240388, TC-113852, V4558, K-6406, I01-11205, C7H4BrClO2,

Complexity	155
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.908g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	235.461g/mol
Monoisotopic Mass	233.908g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number