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2,2-Dibromo-1-(thiophen-2-yl)ethan-1-one

HCID 818879
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
68672-88-8
Standard SMILES
O=C(c1cccs1)C(Br)Br
InChIKey
IZMIXWHNOFTCSY-UHFFFAOYSA-N
Molecular formula
C6H4Br2OS
Average molar mass
283.97 g/mol
Monoisotopic mass
281.83495995

Names & identifiers

Preferred name
2,2-Dibromo-1-(thiophen-2-yl)ethan-1-one
IUPAC
2,2-dibromo-1-thiophen-2-ylethanone
English name
2,2-DibroMo-1-thiophen-2-yl-ethanone
Molecular formula
C6H4Br2OS
Molecular weight
283.97

Names & synonyms

68672-88-82,2-dibromo-1-(thiophen-2-yl)ethan-1-oneDTXSID30355994RefChem:243096DTXCID703070532,2-Dibromo-1-thiophen-2-yl-ethanone2,2-DIBROMO-1-(THIOPHEN-2-YL)ETHANONE2,2-dibromo-1-thiophen-2-ylethanoneEthanone, 2,2-dibromo-1-(2-thienyl)-MFCD018598612,2-dibromo-1-(2-thienyl)ethanone2-(dibromoacetyl)thiophene
Show more names
2,2-dibromo-1-thien-2-ylethanoneSCHEMBL8561978IZMIXWHNOFTCSY-UHFFFAOYSA-NAKOS015994828SY288523DB-364302CS-0136807E79649

Database identifiers

CAS
68672-88-8
PubChem CID
818879
DTXSID
DTXSID30355994
Nikkaji
J627.944I

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
45.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
10
Formal charge
0
Complexity
138

Physicochemical properties

storage temp.
2 · 2-8°C, stored under nitrogen
Appearance
White to light yellow Solid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

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

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers10 total

北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
苏州施亚生物科技有限公司17715136450 · [email protected]
苏州施亚生物科技有限公司86(512)5235 8471 17715136450 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海毓川医药科技有限公司02161555100
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]

Related reactions

1 records
New reaction record
HRID 2286458 reaction equation
HRID 2286458As reactantuspto-grants-1981_05

Compound notes

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