Basic information
- CAS
243-46-9- Standard SMILES
c1ccc2cc3c(cc2c1)sc1ccccc13- InChIKey
UWMISBRPSJFHIR-UHFFFAOYSA-N- Molecular formula
- C16H10S
- Average molar mass
- 234.3 g/mol
- Monoisotopic mass
- 234.05032149
Overview
structure given in first source
Names & identifiers
- Preferred name
- Benzo(b)naphtho(2,3-d)thiophene
- IUPAC
- naphtho[2,3-b][1]benzothiole
- English name
- BENZONAPHTHOTHIOPHENE
- Molecular formula
- C16H10S
- Molecular weight
- 234.3156
Names & synonyms
Benzo[b]naphtho[2,3-d]thiophene243-46-9BENZO(B)NAPHTHO(2,3-D)THIOPHENEH53JV5C3NADTXSID5075442RefChem:565160DTXCID20370552,3-BNT205-956-4naphtho[2,3-b][1]benzothioleBenzonaphthothiopheneBENZO (b) NAPHTHO (2,3-d) THIOPHENE (purity)
Show more names
61523-34-0Naphtho[2,3-b][1]benzothiopheneEINECS 205-956-4SCHEMBL2742087Naphtho[3,2-b][1]benzothioleSCHEMBL20553754SCHEMBL26132467SCHEMBL28512782
Database identifiers
- CAS
243-46-9、61523-34-0- PubChem CID
- 9203
- DTXSID
DTXSID5075442- UNII
- H53JV5C3NA
- EC Number
- 205-956-4
- Nikkaji
- J193.689A
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 287
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Other Aromatic Compounds
LogP5.07
Vapor Pressure0.0000009 [mmHg]
Physical DescriptionAlmost white solid; [Acros Organics MSDS]
Physicochemical properties
- EPA Substance Registry System
- Benzonaphthothiophene (61523-34-0)
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, P391, 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
Hazards SummarySee Dibenzothiophene.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers10 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
艾科试剂4008-755-333 18080918076 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
山东小野化学股份有限公司0539-6362799 20）
浙江虹舞科技有限公司19705058148 · [email protected]
重庆志圣科技有限公司023-67586781 17783613370 · [email protected]
Aladdin Scientific[email protected]
河南威梯希化工科技有限公司0371-55135753 18003832934 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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