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methyl 4-azidobenzoate

methyl 4-azidobenzoate structure

CAS No:
20442-96-0
Formula:
C8H7N3O2
Chemical Name:
methyl 4-azidobenzoate
Synonyms:
methyl 4-azidobenzoate;Benzoic acid, 4-azido-, methyl ester;20442-96-0;4-Azidobenzoic acid methyl ester;DTXSID40174390;ZINC31430130;A1-16721;F2157-0526;Methyl 4-azidobenzoate solution, ~0.5 M in tert-butyl methyl ether, >=95% (HPLC)

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methyl 4-azidobenzoate Basic Attributes

Molecular Weight：

177.16 g/mol

Exact Mass：

177.053826475 g/mol

DSSTox ID：

DTXSID40174390

HScode：

2929909090

Characteristics

PSA：

40.7 Å²

XLogP3：

1.86776

Safety Information

GHS Classification：

|Danger|H241 (97.44%): Heating may cause a fire or explosion [Danger Self-reactive substances and mixtures; Organic peroxides]|P210, P220, P234, P260, P261, P264, P270, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P314, P321, P332+P313, P337+P313, P362, P370+P378, P370+P380+P375, P403+P233, P403+P235, P405, P411, P420, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:177.16
XLogP3:2.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:177.053826475
Monoisotopic Mass:177.053826475
Topological Polar Surface Area:40.7
Heavy Atom Count:13
Complexity:228
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of methyl 4-azidobenzoate

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

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