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tert-butyl N-[2-(3,4-dihydroxyphenyl)ethyl]carbamate

tert-butyl N-[2-(3,4-dihydroxyphenyl)ethyl]carbamate structure

CAS No:
37034-31-4
Formula:
C13H19NO4
Chemical Name:
tert-butyl N-[2-(3,4-dihydroxyphenyl)ethyl]carbamate
Synonyms:
Boc-dopamine; tert-butyl 3,4-dihydroxyphenethylcarbamate; N-Boc-dopamine; tert-butyl 2-(3,4-dihydroxyphenyl)ethylcarbamate; Carbamic acid,[2-(3,4-dihydroxyphenyl)ethyl]-,1,1-dimethylethyl ester; N-tert-butoxycarbonyl-3,4-dihydroxiphenylethylamine; N-(tert-butoxycarbonyl)dopamine;Expand
Categories:
Pharmaceutical Intermediates > Antipsychotics

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tert-butyl N-[2-(3,4-dihydroxyphenyl)ethyl]carbamate Basic Attributes

Molecular Weight：

253.29400

Exact Mass：

253.13140809

DSSTox ID：

DTXSID80515541

Characteristics

PSA：

82.28000

XLogP3：

2.36940

Density：

1.184g/cm3

Boiling Point：

442.807ºC at 760 mmHg

Flash Point：

221.602ºC

Refractive Index：

1.549

Computed Properties

Molecular Weight:253.29
XLogP3:0.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:253.13140809
Monoisotopic Mass:253.13140809
Topological Polar Surface Area:78.8
Heavy Atom Count:18
Complexity:275
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of tert-butyl N-[2-(3,4-dihydroxyphenyl)ethyl]carbamate

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