AG003KNZ

106876-54-4 | 4-Amino-2,2-difluoro-1,3-benzodioxole

AG003KNZ

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CAS Number	106876-54-4
Catalog Number	AG003KNZ(AGN-PC-0KK851)
Chemical Name	4-Amino-2,2-difluoro-1,3-benzodioxole
IUPAC Name	2,2-difluoro-1,3-benzodioxol-4-amine
InChI	InChI=1S/C7H5F2NO2/c8-7(9)11-5-3-1-2-4(10)6(5)12-7/h1-3H,10H2
InChI Key	RXIKYXZKSIARLN-UHFFFAOYSA-N
MDL Number	MFCD00792416
Molecular Formula	C7H5F2NO2
Molecular Weight	173.1169
SMILES	NC1=CC=CC2=C1OC(F)(F)O2
Synonyms	4-AMINO-2,2-DIFLUORO-1,3-BENZODIOXOLE, 106876-54-4, 2,2-difluorobenzo[d][1,3]dioxol-4-amine, 2,2-difluoro-1,3-benzodioxol-4-amine, 2,3-(Difluoromethylenedioxy)aniline, 2,2-DIFLUORO-4-AMINO-1,3-BENZODIOXOLE, MFCD00792416, 1,3-Benzodioxol-4-amine, 2,2-difluoro-, 2,2-DIFLUORO-2H-1,3-BENZODIOXOL-4-AMINE, 2,2-DIFLUORO-BENZO[1,3]DIOXOL-4-YLAMINE, 2,3-(difluoromethylenedioxy)-aniline, ACMC-1BTZE, AC1MC6GV, SCHEMBL334653, BEN788, CTK4A4831, DTXSID60371682, RXIKYXZKSIARLN-UHFFFAOYSA-N, ZINC2569255, 1473AA, ANW-57864, SBB088733, AKOS006229603, ACN-048988, CA-2030, EF10131, MCULE-8546506898, 2,2-Difluoro-1,3-benzodioxole-4-amine, 4-amino-2,2-diflouro-1,3-benzodioxole, 4-amino-2,2-difluorobenzo-1,3-dioxole, 1,3-Benzodioxol-4-amine,2,2-difluoro-, 2,2-DIFLUORO-4-AMINOBENZODIOXOLE, 4-AMINO-2,2-DIFLUOROBENZODIOXOLE, AJ-41690, AK-32784, AN-33854, DS-12045, SC-27925, 4-Amino-2,2-difluoro-benzo(1.3)dioxole, RT-009346, 4-Amino-2,2-difluorobenzo[d][1,3]dioxole, 4CH-023700, A2047, FT-0609232, ST24043193, ST50407328, 2,2-difluorobenzo[d]1,3-dioxolane-4-ylamine, 2,2-difluorobenzo[d]1,3-dioxolene-4-ylamine, 170272-EP2275413A1, 170272-EP2287156A1, 876A544, 3S100194, 3S210872, 4-Amino-2,2-difluoro-1,3-benzodioxole, AldrichCPR, J-514312, I14-14172, C7H5F2NO2, ZINC02569255, CID2736891, 4-Amino-2,2-difluoro-1,3-benzodioxole, 97% 1g,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	173.029g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	173.119g/mol
Monoisotopic Mass	173.029g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	44.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H311-H315-H319-H332
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338-P311
UN Code	UN 2810

Certificate of Analysis

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