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2,3-Dihydro-3-oxo-1H-indene-5-carbonitrile

2,3-Dihydro-3-oxo-1H-indene-5-carbonitrile structure

CAS No:
69975-66-2
Formula:
C10H7NO
Chemical Name:
2,3-Dihydro-3-oxo-1H-indene-5-carbonitrile
Synonyms:
1H-Indene-5-carbonitrile,2,3-dihydro-3-oxo-;2,3-Dihydro-3-oxo-1H-indene-5-carbonitrile;6-Cyano-1-indanone;3-Oxo-1,2-dihydroindene-5-carbonitrile;3-Oxo-2,3-dihydro-1H-indene-5-carbonitrile;3-Oxo-indan-5-carbonitrile

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2,3-Dihydro-3-oxo-1H-indene-5-carbonitrile Basic Attributes

Molecular Weight：

157.16900

Exact Mass：

157.17

DSSTox ID：

DTXSID10452470

HScode：

2926909090

Characteristics

PSA：

40.86000

XLogP3：

1.68718

Density：

1.237g/cm3

Melting Point：

109 °C

Boiling Point：

312.596ºC at 760 mmHg

Flash Point：

142.853ºC

Refractive Index：

1.596

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:157.17
XLogP3:1.4
Hydrogen Bond Acceptor Count:2
Exact Mass:157.052763847
Monoisotopic Mass:157.052763847
Topological Polar Surface Area:40.9
Heavy Atom Count:12
Complexity:250
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,3-Dihydro-3-oxo-1H-indene-5-carbonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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