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1-(5-METHOXY-1H-INDOL-3-YL)ETHANONE

1-(5-METHOXY-1H-INDOL-3-YL)ETHANONE structure

CAS No:
51843-22-2
Formula:
C11H11NO2
Chemical Name:
1-(5-METHOXY-1H-INDOL-3-YL)ETHANONE
Synonyms:
3-acetyl-5-methoxy-1H-indole; 3-acetyl-5-methoxyindole; 5-methoxy-3-acetylindole; 3-Acetyl-5-methoxy-indol;

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1-(5-METHOXY-1H-INDOL-3-YL)ETHANONE Basic Attributes

Molecular Weight：

189.21100

Exact Mass：

189.078978594

DSSTox ID：

DTXSID10600510

HScode：

2933990090

Characteristics

PSA：

42.09000

XLogP3：

2.37910

Density：

1.202g/cm3

Melting Point：

286ºC

Boiling Point：

371.8ºC at 760 mmHg

Flash Point：

178.7ºC

Refractive Index：

1.619

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:189.21
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:189.078978594
Monoisotopic Mass:189.078978594
Topological Polar Surface Area:42.1
Heavy Atom Count:14
Complexity:229
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(5-METHOXY-1H-INDOL-3-YL)ETHANONE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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