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METHYL5-BROMO-1H-INDAZOLE-3-CARBOXYLATE

METHYL5-BROMO-1H-INDAZOLE-3-CARBOXYLATE structure

CAS No:
78155-74-5
Formula:
C9H7BrN2O2
Chemical Name:
METHYL5-BROMO-1H-INDAZOLE-3-CARBOXYLATE
Synonyms:
METHYL 5-BROMO-1H-INDAZOLE-3-CARBOXYLATE;5-Bromo-3-(methoxycarbonyl)-1H-indazole;5-Bromo-1H-indazole-3-carboxylic acid methyl ester;1H-Indazole-3-carboxylicacid,5-broMo-,Methylester;Methyl 5-bromo-1H-indazol...

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METHYL5-BROMO-1H-INDAZOLE-3-CARBOXYLATE Basic Attributes

Molecular Weight：

255.07

Exact Mass：

253.96909

DSSTox ID：

DTXSID90506965

HScode：

2933990090

Characteristics

PSA：

54.98000

XLogP3：

2.11200

Density：

1.709

Melting Point：

208-210℃

Boiling Point：

399.7±22.0 °C(Predicted)

Flash Point：

195.5ºC

Refractive Index：

1.675

PKA：

10.67±0.40

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:255.07
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:253.96909
Monoisotopic Mass:253.96909
Topological Polar Surface Area:55
Heavy Atom Count:14
Complexity:237
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of METHYL5-BROMO-1H-INDAZOLE-3-CARBOXYLATE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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