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5-Acetoxyindole

5-Acetoxyindole structure

CAS No:
5594-91-2
Formula:
C10H9NO2
Chemical Name:
5-Acetoxyindole
Synonyms:
5-Acetoxyindole;1H-indol-5-yl Acetate;1H-Indol-5-ol, 5-acetate;5-Acetoxy-1H-indole;1H-indol-5-yl ethanoate;SCHEMBL272553;DTXSID10469225;acetic acid 1H-indol-5-yl ester;Ethyl5-acetyloxyindole-2-carboxylate;BCP029260
Categories:
Organic Chemistry > Heterocyclic Ring

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5-Acetoxyindole Basic Attributes

Molecular Weight：

175.18396

Exact Mass：

175.06300

DSSTox ID：

DTXSID10469225

HScode：

2933990090

Characteristics

PSA：

42.1

XLogP3：

2.09320

Density：

1.256g/cm3

Melting Point：

113-114 °C

Boiling Point：

339.08ºC at 760 mmHg

Flash Point：

158.87ºC

Refractive Index：

1.634

Computed Properties

Molecular Weight:175.18
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:175.063328530
Monoisotopic Mass:175.063328530
Topological Polar Surface Area:42.1
Heavy Atom Count:13
Complexity:205
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 5594-91-2

Grade: Industrial Grade

Content: 99%

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