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7-Methoxyindole

7-Methoxyindole structure

CAS No:
3189-22-8
Formula:
C9H9NO
Chemical Name:
7-Methoxyindole
Synonyms:
1H-Indole,7-methoxy-;Indole,7-methoxy-;7-Methoxy-1H-indole;7-Methoxyindole;NSC 100739;7-(Methyloxy)-1H-indole
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

Pale brown to brown liquid

7-Methoxyindole Basic Attributes

Molecular Weight：

147.177

Exact Mass：

147.17

EC Number：

221-690-1

UNII：

9R05QK9RP4

NSC Number：

100739

DSSTox ID：

DTXSID90185739

HScode：

2933990090

Characteristics

PSA：

XLogP3：

2.8

Appearance：

Yellowish liquid

Density：

1.2±0.1 g/cm3

Melting Point：

147-150°C

Boiling Point：

157 °C @ Press: 17 Torr

Flash Point：

109.2±10.1 °C

Refractive Index：

1.637

Storage Conditions：

-20ºC

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

Stability/Shelf Life：

Stable normal temperatures and pressures.

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H302-H315-H318-H335

GHS Classification：

|Danger|H302 (88.64%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 44 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:147.17
XLogP3:2.8
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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