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Tryptophol

Tryptophol structure

CAS No:
526-55-6
Formula:
C10H11NO
Chemical Name:
Tryptophol
Synonyms:
1H-Indole-3-ethanol;Indole-3-ethanol;Tryptophol;3-(2-Hydroxyethyl)indole;IEA;β-(3-Indole)ethanol;2-(3-Indolyl)ethanol;3-(β-Hydroxyethyl)indole;3-(2-Hydroxyethyl)-1H-indole;NSC 3884;2-(1H-Indol-3-yl)ethanol;2-(1H-Indol-3-yl)ethan-1-ol
Categories:
Natural Products > Alkaloids

Description

off-white to brown crystalline mass, crystals,

Solid

Tryptophol is an indolyl alcohol that is ethanol substituted by a 1H-indol-3-yl group at position 2. It has a role as a Saccharomyces cerevisiae metabolite, an auxin and a plant metabolite.

Tryptophol Basic Attributes

Molecular Weight：

161.2

Exact Mass：

161.20

BRN：

125553

EC Number：

208-393-2

UNII：

5809LZ7G1U

NSC Number：

3884

DSSTox ID：

DTXSID2060173

HScode：

29339990

Characteristics

PSA：

XLogP3：

1.8

Appearance：

Off-white to brown Crystalline Mass, Crystals, Flakes or Powder

Density：

1.2±0.1 g/cm3

Melting Point：

59 °C

Boiling Point：

174 °C @ Press: 2 Torr

Flash Point：

255 °C

Refractive Index：

1.674

Water Solubility：

H2O: 10 g/L (20 ºC);methanol: 0.1 g/mL, clear

Storage Conditions：

2-8°C

Toxicity：

LD50 intraperitoneal in mouse: 351mg/kg

Collision Cross Section：

133.6 Å² [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|132.6 Å² [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|133 Å² [M-H]-

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

safety instructions：

24/25

RTECS Number：

KL3685000

Marks：

Hazard note：

Irritant

Stability/Shelf Life：

Stable under normal temperatures and pressures.

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

Drug Information

MeSH Entry Terms：

indole-3-ethanol

Tryptophol Use and Manufacturing

Uses

Biochemical research. Used as an organic synthesis reagent.

Manufacturing Info：

1H-Indole-3-ethanol: ACTIVE

Computed Properties

Molecular Weight:161.20
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:161.084063974
Monoisotopic Mass:161.084063974
Topological Polar Surface Area:36
Heavy Atom Count:12
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 526-55-6

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Guide of Tryptophol

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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Tryptophol

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