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1,1-Dimethylethyl 4-bromo-3-(hydroxymethyl)-1H-indole-1-carboxylate

1,1-Dimethylethyl 4-bromo-3-(hydroxymethyl)-1H-indole-1-carboxylate structure

CAS No:
914349-05-6
Formula:
C14H16BrNO3
Chemical Name:
1,1-Dimethylethyl 4-bromo-3-(hydroxymethyl)-1H-indole-1-carboxylate
Synonyms:
1H-Indole-1-carboxylic acid,4-bromo-3-(hydroxymethyl)-,1,1-dimethylethyl ester;1,1-Dimethylethyl 4-bromo-3-(hydroxymethyl)-1H-indole-1-carboxylate;N-Boc-4-bromo-1H-indole-3-methanol;1-Boc-4-Bromo-3-hydroxymethylindole

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1,1-Dimethylethyl 4-bromo-3-(hydroxymethyl)-1H-indole-1-carboxylate Basic Attributes

Molecular Weight：

326.188

Exact Mass：

326.19

DSSTox ID：

DTXSID30654318

HScode：

2933990090

Characteristics

PSA：

51.46000

XLogP3：

3.67930

Density：

1.42g/cm3

Boiling Point：

442.1ºC at 760 mmHg

Flash Point：

221.2ºC

Refractive Index：

1.585

Computed Properties

Molecular Weight:326.19
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:325.03136
Monoisotopic Mass:325.03136
Topological Polar Surface Area:51.5
Heavy Atom Count:19
Complexity:342
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,1-Dimethylethyl 4-bromo-3-(hydroxymethyl)-1H-indole-1-carboxylate

Basic Attributes
Characteristics
Computed Properties
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1,1-Dimethylethyl 4-bromo-3-(hydroxymethyl)-1H-indole-1-carboxylate

SDS

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