Basic information
- CAS
123597-55-7- Standard SMILES
CCCCCCCCCCNc1cc(CO)c2cc[nH]c2c1- InChIKey
CHLOVPDKABYEDC-UHFFFAOYSA-N- Molecular formula
- C19H30N2O
- Average molar mass
- 302.5 g/mol
- Monoisotopic mass
- 302.23581359
Names & identifiers
- Preferred name
- 6-(N-decylamino)-4-hydroxymethylindole
- IUPAC
- [6-(decylamino)-1H-indol-4-yl]methanol
- English name
- 6-(N-DECYLAMINO)-4-HYDROXYMETHYLINDOLE
- Molecular formula
- C19H30N2O
- Molecular weight
- 302.45
Names & synonyms
123597-55-76-(N-Decylamino)-4-hydroxymethylindole6-DHIDTXSID80154050RefChem:104107DTXCID5076541634-145-11H-Indole-4-methanol, 6-(decylamino)-[6-(decylamino)-1H-indol-4-yl]methanol(6-(Decylamino)-1H-indol-4-yl)methanol1H-Indole-4-methanol,6-(decylamino)-SCHEMBL5052863
Show more names
DHI
SCHEMBL29539155HSCI1_000013
Database identifiers
- CAS
123597-55-7- PubChem CID
- 3010
- DTXSID
DTXSID80154050- EC Number
- 634-145-1
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 285
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H315-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers1 total
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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