AG001C7Z

1402667-16-6 | Isobenzofuran, 4-bromo-1,3-dihydro-

AG001C7Z

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CAS Number	1402667-16-6
Catalog Number	AG001C7Z(AGN-PC-0WAA0N)
Chemical Name	Isobenzofuran, 4-bromo-1,3-dihydro-
IUPAC Name	4-bromo-1,3-dihydro-2-benzofuran
InChI	InChI=1S/C8H7BrO/c9-8-3-1-2-6-4-10-5-7(6)8/h1-3H,4-5H2
InChI Key	SBASERJDRPYLCK-UHFFFAOYSA-N
MDL Number	MFCD22397733
Molecular Formula	C8H7BrO
Molecular Weight	199.0446
SMILES	BrC1=CC=CC2=C1COC2
Synonyms	4-Bromo-1,3-dihydroisobenzofuran, 1402667-16-6, 4-BROMO-1,3-DIHYDRO-2-BENZOFURAN, AK208702, SCHEMBL20241845, KS-00000DE4, 6100AJ, MFCD22397733, ZINC95635411, AKOS024258014, Isobenzofuran, 4-bromo-1,3-dihydro-, FCH1636662, TRA0050069, DS-10161, SY022575, CS-0060666, Z-3379, MFCD22397733 (95+%), C8H7BrO, 4-bromo-1,3-dihydro-Isobenzofuran,

Complexity	126
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.968g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	199.047g/mol
Monoisotopic Mass	197.968g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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