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2,5-dimethyl-4-nitrobenzonitrile

2,5-dimethyl-4-nitrobenzonitrile structure

CAS No:
73713-69-6
Formula:
C9H8N2O2
Chemical Name:
2,5-dimethyl-4-nitrobenzonitrile
Synonyms:
2,5-Dimethyl-4-nitrobenzonitrile;73713-69-6;BENZONITRILE, 2,5-DIMETHYL-4-NITRO-;WLN: WNR B1 E1 DCN;Benzonitrile,5-dimethyl-4-nitro-;NSC 67712;BRN 3261793;NSC76088;NCIOpen2_000304;UNII-98SW7QB5K2;3-09-00-02441 (Beilstein Handbook Reference);98SW7QB5K2;SCHEMBL7024321;DTXSID50224017;NSC67712;ZINC1694603;NSC-67712;NSC-76088;AKOS024260896;MCULE-1933143163;NE31553;Z1649893441

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2,5-dimethyl-4-nitrobenzonitrile Basic Attributes

Molecular Weight：

176.17 g/mol

Exact Mass：

176.058577502 g/mol

UNII：

98SW7QB5K2

NSC Number：

76088|67712

DSSTox ID：

DTXSID50224017

Characteristics

PSA：

69.6 Å²

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:176.17
XLogP3:2.2
Hydrogen Bond Acceptor Count:3
Exact Mass:176.058577502
Monoisotopic Mass:176.058577502
Topological Polar Surface Area:69.6
Heavy Atom Count:13
Complexity:250
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: tert butyl methyl ether; calcium sulfite; 2-chlorobenzoic acid; n2o3 name; hydrogen sulphide formula; enterobacter cloacae

Guide of 2,5-dimethyl-4-nitrobenzonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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