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Dibenzothiophene, 2-nitro-

HCID 95072
NotesReactions

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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
6639-36-7
Standard SMILES
O=[N+]([O-])c1ccc2sc3ccccc3c2c1
InChIKey
GXLYVLHWXVRVKI-UHFFFAOYSA-N
Molecular formula
C12H7NO2S
Average molar mass
229.26 g/mol
Monoisotopic mass
229.01974946

Names & identifiers

Preferred name
Dibenzothiophene, 2-nitro-
IUPAC
2-Nitrodibenzo[b,d]thiophene
English name
2-Nitrodibenzothiophene
Molecular formula
C12H7NO2S
Molecular weight
229.25

Names & synonyms

NSC 160622-Nitrodibenzothiophene2-nitro-dibenzothiophen2-Nitrodibenzo[b]thiopheneDibenzothiophene, 2-nitro-2-Nitrodibenzothiophene in isooctane2-Nitrodibenzothiophene @100 μg/mL in Toluene2-NITRODIBENZOTHIOPHENE (100UG/ML IN TOLUENE)3-Nitro-9-thiafluorene, 5-Nitro-[1,1'-biphenyl]-2,2-diyl sulphide

Database identifiers

CAS
6639-36-7
PubChem CID
95072
DTXSID
DTXSID00216609
UNII
EK8F3V9FW3
EC Number
622-552-7
Nikkaji
J364.307G

Properties

Physicochemical properties

Melting point
186 ℃ · 186℃
Boiling point
423 ℃ · 423℃
Density
1.441 · 1.441
Flash point
209 ℃ · 209℃
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
solubility
Chloroform (Sparingly), DMSO (Slightly, Sonicated)
form
Solid
color
Pale Yellow to Light Yellow
Henry's Law Constant
1.2 · 1.2×102 mol/(m3Pa) at 25℃, Parnis et al. (2015)
FDA UNII
8 F3V9FW3 · EK8F3V9FW3
Symbol(GHS)
6 · GHS06
Signal word
Danger
Hazard statements
301 · H301-H413
Precautionary statements
301 · P301+P310
HS Code
2934208090 · 2934208090

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

hs_code
2934208090
Signal word
Danger
Symbol(GHS)
GHS06
Hazard statements
H301-H413
Precautionary statements
P301+P310

Chemistry & industry

Applications

Uses2-Nitrodibenzothiophene is a nitrated polycyclic aromatic hydrocarbon (PAH). 2-Nitrodibenzothiophene is removed from coal by hydrogenation in Tetralin.

Suppliers23 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海波以尔化工有限公司[email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
济南德迈医药科技有限公司18669728830 15806766175 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
南京毕科生物科技有限公司025-58906079 15151970915 · [email protected]
上海默达医药科技有限公司+86 (0)21 51320687 51371369 1744605818
上海凯睿生物科技有限公司021-5068 3667/17749785980/1029026415; 17749785980 · [email protected]
许昌峰飞新材料科技有限公司19713077352; 19713077352 · [email protected]
上海途志化工有限公司19542790274 · [email protected]
南京熠康达医药科技有限公司18118984557; 18118984557 · [email protected]

Related reactions

4 records
New reaction record
HRID 1064025 reaction equation
HRID 1064025As reactantuspto-grants-2005_11
HRID 1503195 reaction equation
HRID 1503195As productuspto-grants-2015_12
HRID 2055331 reaction equation
HRID 2055331As reactantuspto-grants-2008_02
HRID 2320478 reaction equation
HRID 2320478As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
浙江虹舞科技有限公司19705058148 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
山东鸿图生物科技有限公司15318761660 15966937598 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
上海蓝乐鸟实业有限公司15021845385 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]