Basic information
- CAS
13228-36-9- Standard SMILES
Cc1ccc2[nH]c(-c3ccccc3)cc2c1- InChIKey
JPFTUUXPCFNLIX-UHFFFAOYSA-N- Molecular formula
- C15H13N
- Average molar mass
- 207.27 g/mol
- Monoisotopic mass
- 207.10479942
Names & identifiers
- Preferred name
- 1H-Indole, 5-methyl-2-phenyl-
- IUPAC
- 5-methyl-2-phenyl-1H-indole
- English name
- 5-METHYL-2-PHENYLINDOLE
- Molecular formula
- C15H13N
- Molecular weight
- 207.27
Names & synonyms
5-Methyl-2-phenyl-1H-indole13228-36-95-Methyl-2-phenylindole1H-Indole, 5-methyl-2-phenyl-2-Phenyl-5-methylindoleIndole, 5-methyl-2-phenyl-DTXSID9074692NSC 101085RefChem:438695DTXCID7034090634-349-0MFCD00022700
Show more names
5-METHYL-2-PHENYLINDOLE, 97% MIN.
(5-Methyl-1H-indol-2-yl)benzeneNSC101085SCHEMBL2362656SCHEMBL113309875-Methyl-2-phenyl-1H-indole #STK752226AKOS001723020HS-7819
Database identifiers
- CAS
13228-36-9- PubChem CID
- 83247
- DTXSID
DTXSID9074692- EC Number
- 634-349-0
- Nikkaji
- J101.735G
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 15.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 232
Physicochemical properties
- Melting point
- 214 · 214-215 °C
- Boiling point
- 404.2 · 404.2±14.0 °C(Predicted)
- Density
- 1.129 · 1.129±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- 16.97 · 16.97±0.30(Predicted)
- Appearance
- Off-white to light yellow Solid
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- 1 H-Indole, · 1H-Indole, 5-methyl-2-phenyl- (13228-36-9)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 413 · H413-H335-H315-H318
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
- HS Code
- 2933998090 · 2933998090
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2933998090
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H413-H335-H315-H318
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers17 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海合寰化工科技有限公司18621911604 · [email protected]
Related reactions
1 records
Compound notes
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