Basic information
- CAS
3263-79-4- Standard SMILES
c1ccc(-c2[nH]c(-c3ccccc3)c(-c3ccccc3)c2-c2ccccc2)cc1- InChIKey
IEZVMRGFNUNABR-UHFFFAOYSA-N- Molecular formula
- C28H21N
- Average molar mass
- 371.5 g/mol
- Monoisotopic mass
- 371.16739967
Names & identifiers
- Preferred name
- 1H-Pyrrole, 2,3,4,5-tetraphenyl-
- IUPAC
- 2,3,4,5-tetraphenyl-1H-pyrrole
- English name
- 2,3,4,5-Tetraphenylpyrrole
- Molecular formula
- C28H21N
- Molecular weight
- 371.47
Names & synonyms
2,3,4,5-Tetraphenyl-1H-pyrrole2,3,4,5-Tetraphenylpyrrole1H-Pyrrole, 2,3,4,5-tetraphenyl-Pyrrole, 2,3,4,5-tetraphenyl-NSC 230402DTXSID8062941RefChem:439165DTXCID5038547636-512-13263-79-4TetraphenylpyrroleMFCD00053539
Show more names
S647UTC2NXNSC-230402tetraphenyl-pyrroleNSC2304022,4,5-TetraphenylpyrroleUNII-S647UTC2NXPyrrole,3,4,5-tetraphenyl-SCHEMBL3278733
Database identifiers
- CAS
3263-79-4- PubChem CID
- 76753
- DTXSID
DTXSID8062941- UNII
- S647UTC2NX
- EC Number
- 636-512-1
- Nikkaji
- J387.721C
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 15.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 433
Physicochemical properties
- Melting point
- 221 · 221-222 °C
- Boiling point
- 472.2 · 472.2±34.0 °C(Predicted)
- Density
- 1.129 · 1.129±0.06 g/cm3(Predicted)
- pka
- 16.4 · 16.40±0.50(Predicted)
- FDA UNII
- 647 UTC2NX · S647UTC2NX
- EPA Substance Registry System
- 1 H-Pyrrole, · 1H-Pyrrole, 2,3,4,5-tetraphenyl- (3263-79-4)
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 319 · H319-H301-H335-H413-H315
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- TSCA
- TSCA listed
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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, 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)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- tsca
- TSCA listed
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H319-H301-H335-H413-H315
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Pyrrole, 2,3,4,5-tetraphenyl-: INACTIVE
Suppliers10 total
上海铂之泉科技有限公司13681726990 13681726990 · [email protected]
上海微佳禾生物科技有限公司17502176150; 17502176150 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
河南东元化工科技有限公司16696119288 · [email protected]
河南普赛化工产品有限公司0371-60919097 15378766539 · [email protected]
河南阿尔法化工有限公司0371-55055611 18137792234 · [email protected]
河南利恩化工产品有限公司03716091-9097 13383857418 · [email protected]
郑州浩创新材料有限公司19139721821; 19139721821 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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