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1,1-Dimethylethyl 5-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate

1,1-Dimethylethyl 5-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate structure

CAS No:
928653-80-9
Formula:
C12H13BrN2O2
Chemical Name:
1,1-Dimethylethyl 5-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate
Synonyms:
1H-Pyrrolo[2,3-b]pyridine-1-carboxylic acid,5-bromo-,1,1-dimethylethyl ester;1,1-Dimethylethyl 5-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate

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1,1-Dimethylethyl 5-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate Basic Attributes

Molecular Weight：

297.16

Exact Mass：

297.15

DSSTox ID：

DTXSID20640124

Characteristics

PSA：

44.1

XLogP3：

3.58200

Density：

1.46g/cm3

Boiling Point：

361.8ºC at 760 mmHg

Flash Point：

172.6ºC

Refractive Index：

1.599

Safety Information

Hazard category：

IRRITANT

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

Marks：

Xi,Xn

Hazard Statements：

H302

Computed Properties

Molecular Weight:297.15
XLogP3:3.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:296.01604
Monoisotopic Mass:296.01604
Topological Polar Surface Area:44.1
Heavy Atom Count:17
Complexity:303
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,1-Dimethylethyl 5-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate

Basic Attributes
Characteristics
Safety Information
Computed Properties
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1,1-Dimethylethyl 5-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate

SDS

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