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1,5-Dibromo-3-fluoro-2-iodobenzene

HCID 11090199
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
202982-76-1
Standard SMILES
Fc1cc(Br)cc(Br)c1I
InChIKey
SWURVCDCHYBPGQ-UHFFFAOYSA-N
Molecular formula
C6H2Br2FI
Average molar mass
379.79 g/mol
Monoisotopic mass
377.7552

Names & identifiers

Preferred name
1,5-Dibromo-3-fluoro-2-iodobenzene
IUPAC
1,5-dibromo-3-fluoro-2-iodobenzene
English name
2,4-Dibromo-6-fluoroiodobenzene
Molecular formula
C6H2Br2FI
Molecular weight
379.79

Names & synonyms

1,5-dibromo-3-fluoro-2-iodobenzene202982-76-1RefChem:417196107-666-22,4-Dibromo-6-fluoroiodobenzeneMFCD001430721,5-dibromo-3-fluoro-2-iodo-benzeneCIA98276AKOS024263319AS-95031Benzene, 1,5-dibromo-3-fluoro-2-iodo-SY157787
Show more names
CS-0192218E89411EN300-156001F035640

Database identifiers

CAS
202982-76-1
PubChem CID
11090199
EC Number
107-666-2

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
10
Formal charge
0
Complexity
122

Physicochemical properties

Boiling point
293.5 · 293.5±35.0 °C(Predicted)
Density
2.564 · 2.564±0.06 g/cm3(Predicted)
InChI
InChI=1S/C6H2Br2FI/c7-3-1-4(8)6(10)5(9)2-3/h1-2H
InChIKey
SWURVCDCHYBPGQ-UHFFFAOYSA-N
SMILES
C1(Br)=CC(Br)=CC(F)=C1I
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319
Precautionary statements
264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319
Precautionary statements
P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Chemistry & industry

Suppliers12 total

毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
南京代盟化工有限公司02566880956 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
Aceschem Inc.+1-817863-6948 +1-(817)863-6948 · [email protected]
常州鑫研合医药科技有限公司0519-85252752 15366845260 · [email protected]
西安凯翔光电科技有限公司18592059708 · [email protected]
上海康恩博医药科技有限公司(科小研试剂)400-1388-521 17510465506 · [email protected]
上海宏驹医药科技有限公司18001895509 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]

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Compound notes

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