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TERT-BUTYL-N-[3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]CARBAMATE

TERT-BUTYL-N-[3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]CARBAMATE structure

CAS No:
330793-09-4
Formula:
C17H26BNO4
Chemical Name:
TERT-BUTYL-N-[3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]CARBAMATE
Synonyms:
3-(BOC-AMINO)PHENYLBORONIC ACID PINACOL ESTER;3-(TERT-BUTOXYCARBONYLAMINO)PHENYLBORONIC ACID, PINACOL ESTER;T-BUTYL N-[3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE-2-YL)PHENYL]CARBAMATE;TERT-BUTYL-N-[3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]CARBAMATE;tert-Butyl-N-[3-(4,4,5,5-tetramethyl-1,3,2-;3-(Boc-amino)benzeneboronic acid pinacol ester, 97%;3-(Boc-amino)phenylboronic acid pinacol ester, tert-Butyl-N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate;3-Aminobenzeneboronic acid, pinacol ester, N-BOC protected
Categories:
Organic Chemistry > Coordination Complexes

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TERT-BUTYL-N-[3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]CARBAMATE Basic Attributes

Molecular Weight：

319.2

Exact Mass：

319.1954885

EC Number：

200-528-9

DSSTox ID：

DTXSID40378598

HScode：

2934999090

Characteristics

PSA：

56.79000

XLogP3：

3.40580

Density：

1.07±0.1 g/cm3

Melting Point：

148-153 °C(lit.)

Boiling Point：

387.0±25.0 °C(Predicted)

Flash Point：

187.8ºC

Refractive Index：

1.504

PKA：

13.97±0.70

Safety Information

wgk germany：

GHS Classification：

|Danger|H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P310, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P363, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:319.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:319.1954885
Monoisotopic Mass:319.1954885
Topological Polar Surface Area:56.8
Heavy Atom Count:23
Complexity:428
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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3-(Boc-amino)benzeneboronic acid pinacol ester

CAS No.: 330793-09-4

Content: 99.00%

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Guide of TERT-BUTYL-N-[3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]CARBAMATE

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