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1,3-dimethyl-2-nitro-5-phenylbenzene

1,3-dimethyl-2-nitro-5-phenylbenzene structure

CAS No:
54810-87-6
Formula:
C14H13NO2
Chemical Name:
1,3-dimethyl-2-nitro-5-phenylbenzene
Synonyms:
1,1'-Biphenyl, 3,5-dimethyl-4-nitro-;54810-87-6;3,5-Dimethyl-4-nitro-1,1'-biphenyl;2,6-DIMETHYL-4-PHENYLNITROBENZENE;3,5-Dimethyl-4-nitrobiphenyl;DTXSID90203306;ZINC2166220;AKOS024324175;MCULE-1724750391

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1,3-dimethyl-2-nitro-5-phenylbenzene Basic Attributes

Molecular Weight：

227.26 g/mol

Exact Mass：

227.094628657 g/mol

DSSTox ID：

DTXSID90203306

Characteristics

PSA：

45.8 Å²

Safety Information

GHS Classification：

|Danger|H302 (100%): 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, 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.

Computed Properties

Molecular Weight:227.26
XLogP3:4.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:227.094628657
Monoisotopic Mass:227.094628657
Topological Polar Surface Area:45.8
Heavy Atom Count:17
Complexity:256
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,3-dimethyl-2-nitro-5-phenylbenzene

Basic Attributes
Characteristics
Safety Information
Computed Properties

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