AG003J01

221220-97-9 | 1-Bromo-2,4-difluoro-3-methylbenzene

AG003J01

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CAS Number	221220-97-9
Catalog Number	AG003J01(AGN-PC-0061J4)
Chemical Name	1-Bromo-2,4-difluoro-3-methylbenzene
IUPAC Name	1-bromo-2,4-difluoro-3-methylbenzene
InChI	InChI=1S/C7H5BrF2/c1-4-6(9)3-2-5(8)7(4)10/h2-3H,1H3
InChI Key	AISIRIFPPGLTCY-UHFFFAOYSA-N
MDL Number	MFCD03412221
Molecular Formula	C7H5BrF2
Molecular Weight	207.0154
SMILES	CC1=C(F)C=CC(Br)=C1F
Synonyms	221220-97-9, 3-bromo-2,6-difluorotoluene, 1-Bromo-2,4-difluoro-3-methylbenzene, 2,4-difluoro-3-methylbromobenzene, 1-bromo-2,4-difluoro-3-methyl-benzene, MFCD03412221, Benzene, 1-bromo-2,4-difluoro-3-methyl-, ACMC-209fsf, KSC494Q0F, SCHEMBL584965, CTK3J4802, DTXSID80461231, AISIRIFPPGLTCY-UHFFFAOYSA-N, KS-00000DA1, ZINC2529894, ZX-AP000742, 3-Methyl-2,4-difluoro-bromobenzene, ANW-24733, PC7858, SBB093785, Bromo-2,4-difluoro-3-methyl-benzene, AKOS005259684, 2,4-Difluoro-3-methyl-1-bromobenzene, 4-bromo-1,3-difluoro-2-methylbenzene, AS06926, CS-W003055, FCH1325671, FS-4005, TRA0052981, VZ22571, ACM221220979, AJ-38462, AK-75994, CC-07418, CJ-09081, SC-66122, SY020677, AB0060536, AX8010323, DB-045805, RT-002187, FT-0644043, ST24037832, Z1907, MFCD03412221 (97%), B-7959, C-10372, I01-9467, C7H5BrF2, 3-bromo-2-fluoro-6-fluorotoluene, ACN-056011, CID11287226, 1-Bromo-2,4-difluoro-3-methylbenzene - 5G 5g, 191605-10-4, 224789-15-5,

Complexity	118
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.954g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	207.018g/mol
Monoisotopic Mass	205.954g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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