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6-Methoxyindole

6-Methoxyindole structure

CAS No:
3189-13-7
Formula:
C9H9NO
Chemical Name:
6-Methoxyindole
Synonyms:
1H-Indole,6-methoxy-;Indole,6-methoxy-;6-Methoxy-1H-indole;6-Methoxyindole;NSC 92517;6-(Methyloxy)-1H-indole
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

white shiny crystals

6-Methoxyindole Basic Attributes

Molecular Weight：

147.17

Exact Mass：

147.17

EC Number：

221-689-6

NSC Number：

92517

DSSTox ID：

DTXSID30185738

HScode：

2933990090

Characteristics

PSA：

XLogP3：

2.6

Appearance：

White crystalline powder

Density：

1.2±0.1 g/cm3

Melting Point：

91-92 °C

Boiling Point：

297.8°C at 760 mmHg

Flash Point：

109.2±10.1 °C

Refractive Index：

1.637

Water Solubility：

15.3 [ug/mL]

Storage Conditions：

Keep Cold

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S26-S36

Marks：

Xi:Irritant

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:147.17
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:147.068413911
Monoisotopic Mass:147.068413911
Topological Polar Surface Area:25
Heavy Atom Count:11
Complexity:138
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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