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1-Methyl-2-phenylindole

1-Methyl-2-phenylindole structure

CAS No:
3558-24-5
Formula:
C15H13N
Chemical Name:
1-Methyl-2-phenylindole
Synonyms:
1H-Indole,1-methyl-2-phenyl-;Indole,1-methyl-2-phenyl-;1-Methyl-2-phenyl-1H-indole;1-Methyl-2-phenylindole;2-Phenyl-N-methylindole;N-Methyl-2-phenylindole;NSC 63793;2-Phenyl-1-methylindole
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

WHITE TO LIGHT GREEN-TAN CRYSTALS OR CRYST. POWDER

1-Methyl-2-phenylindole Basic Attributes

Molecular Weight：

207.27000

Exact Mass：

207.27

EC Number：

222-618-1

UNII：

IE3UB978IA

NSC Number：

63793

DSSTox ID：

DTXSID5063073

HScode：

2933990090

Characteristics

PSA：

4.93000

XLogP3：

3.84530

Appearance：

white crystalline powder

Density：

1.04 g/cm3

Melting Point：

100-101 °C

Boiling Point：

380.8ºC at 760 mmHg

Flash Point：

184.1ºC

Refractive Index：

1.599

Water Solubility：

0.6 [ug/mL]

Storage Conditions：

Store in a cool, dry place. Store in a tightly closed container.

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

S24/25

Marks：

Stability/Shelf Life：

Stable under normal temperatures and pressures.

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 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

1-methyl-2-phenylindole

1-Methyl-2-phenylindole Use and Manufacturing

Uses

Dye intermediate. Used in the production of cationic dyes, such as cationic red 2GL.

Manufacturing Info：

1H-Indole, 1-methyl-2-phenyl-: ACTIVE

Computed Properties

Molecular Weight:207.27
XLogP3:4.1
Rotatable Bond Count:1
Exact Mass:207.104799419
Monoisotopic Mass:207.104799419
Topological Polar Surface Area:4.9
Heavy Atom Count:16
Complexity:232
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

N-Methylaniline

Chlorobenzene

Iodobenzene diacetate

Dimethyl carbonate

Benzene

Hydrochloric acid

Dimethyl sulfate

Ethyl benzoate

o-Toluidine

Downstream Products

Formaldehyde

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