AG003FF3

67869-13-0 | 2,3,5-Tribromo-4-methylthiophene

AG003FF3

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CAS Number	67869-13-0
Catalog Number	AG003FF3(AGN-PC-0KNWZJ)
Chemical Name	2,3,5-Tribromo-4-methylthiophene
EC Number	267-441-0
IUPAC Name	2,3,5-tribromo-4-methylthiophene
InChI	InChI=1S/C5H3Br3S/c1-2-3(6)5(8)9-4(2)7/h1H3
InChI Key	DTLNXOZXOZCNMX-UHFFFAOYSA-N
MDL Number	MFCD00130086
Molecular Formula	C5H3Br3S
Molecular Weight	334.8543
SMILES	CC1=C(Br)SC(Br)=C1Br
Synonyms	2,3,5-Tribromo-4-methylthiophene, 67869-13-0, Thiophene,2,3,5-tribromo-4-methyl-, 3-methyl-2,4,5-tribromothiophene, Thiophene, 2,3,5-tribromo-4-methyl-, EINECS 267-441-0, C5H3Br3S, AC1MI5EK, SCHEMBL845676, ACMC-209o19, CTK5C6807, DTLNXOZXOZCNMX-UHFFFAOYSA-, DTLNXOZXOZCNMX-UHFFFAOYSA-N, 2,4,5-tribromo-3-methylthiophene, KS-000014KA, ZINC2504557, 0457AC, ANW-35419, MFCD00130086, AKOS015951102, TRA0000124, VT20017, AJ-36001, AK112633, PS-10950, 2,3,5-tris(bromanyl)-4-methyl-thiophene, AB1008257, DB-019674, ST2415625, TC-124164, FT-0609444, A835913, InChI=1/C5H3Br3S/c1-2-3(6)5(8)9-4(2)7/h1H3, null, C5-H3-Br3-S, CID3017801, T1682,

Complexity	108
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	333.749g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	334.851g/mol
Monoisotopic Mass	331.751g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	28.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.7

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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