Tryptophanol

HCID 10684

Notes Reactions

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Basic information

CAS: 526-53-4
Standard SMILES: NC(CO)Cc1c[nH]c2ccccc12
InChIKey: UDQCRUSSQAXPJY-UHFFFAOYSA-N
Molecular formula: C11H14N2O
Average molar mass: 190.24 g/mol
Monoisotopic mass: 190.11061307

Overview

RN given refers to cpd without isomeric designation

Names & identifiers

Preferred name: Tryptophanol
IUPAC: 2-amino-3-(1H-indol-3-yl)propan-1-ol
English name: beta-amino-1H-indole-3-propanol
Molecular formula: C11H14N2O
Molecular weight: 190.24

Names & synonyms

526-53-4EINECS 208-392-71H-INDOLE-3-PROPANOL, beta-AMINO-RefChem:9006912-(1H-indol-3-yl)ethan-1-olTRYPTOPHANOL2-amino-3-(1H-indol-3-yl)propan-1-olbeta-Amino-1H-indole-3-propanolMFCD00069710SCHEMBL143812SCHEMBL6546026DTXSID00967028

Show more names

?-amino-1H-indole-3-propanol1H-Indole-3-propanol, β-amino-β-Amino-1H-indole-3-(1-propanol)2-azanyl-3-(1H-indol-3-yl)propan-1-ol3-(1H-Indole-3-yl)-2-amino-1-propanol

UDQCRUSSQAXPJY-UHFFFAOYSA-NAAA52653STR070372-Amino-3-(3-indolyl)-1-propanolAKOS006228060EBC-182235SY1855812-Amino-3-(1H-indol-3-yl)-1-propanol

Database identifiers

CAS: 526-53-4
PubChem CID: 10684
DTXSID: DTXSID00967028
ChEMBL: CHEMBL1222398
EC Number: 208-392-7
Nikkaji: J182.287J

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 62 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 14
Formal charge: 0
Complexity: 186

Physicochemical properties

storage temp.: 2 · 2-8°C, protect from light
Appearance: Light yellow to yellow Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P313-P337+P313-P362-P403+P233-P405-P501

Safety & regulation

GHS classification

GHS Classification · 4 items

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H315-H319-H335
Precautionary statements: P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P313-P337+P313-P362-P403+P233-P405-P501