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N-[(1,1-Dimethylethoxy)carbonyl]-3,5-difluoro-L-phenylalanine

N-[(1,1-Dimethylethoxy)carbonyl]-3,5-difluoro-L-phenylalanine structure

CAS No:
205445-52-9
Formula:
C14H17F2NO4
Chemical Name:
N-[(1,1-Dimethylethoxy)carbonyl]-3,5-difluoro-L-phenylalanine
Synonyms:
L-Phenylalanine,N-[(1,1-dimethylethoxy)carbonyl]-3,5-difluoro-;N-[(1,1-Dimethylethoxy)carbonyl]-3,5-difluoro-L-phenylalanine;(2S)-2-[(tert-Butoxycarbonyl)amino]-3-(3,5-difluorophenyl)propanoic acid;N-(tert-Butoxycarbonyl)-3,5-difluoro-L-phenylalanine;N-Boc-L-3,5-difluorophenylalanine;(S)-N-Boc-3,5-difluorophenylalanine;(2S)-2-[(tert-Butoxycarbonyl)amino]-3-(3,5-difluorophenyl)propionic acid;2-(S)-[(tert-Butoxycarbonyl)amino]-3-(3,5-difluorophenyl)propionic acid;(S)-2-[(tert-Butoxycarbonyl)amino]-3-(3,5-difluorophenyl)propanoic acid;1609983-14-3

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Description

White to off-white powder

N-[(1,1-Dimethylethoxy)carbonyl]-3,5-difluoro-L-phenylalanine Basic Attributes

Molecular Weight：

301.29

Exact Mass：

301.29

HScode：

2924299090

Characteristics

PSA：

75.6

XLogP3：

2.7

Density：

1.3±0.1 g/cm3

Melting Point：

115℃

Boiling Point：

417.6°C at 760 mmHg

Flash Point：

206.4±28.7 °C

Refractive Index：

1.506

Storage Conditions：

Store at 0°C

Vapor Pressure：

1.01E-07mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

Marks：

Hazard note：

Irritant

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:301.29
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:301.11256435
Monoisotopic Mass:301.11256435
Topological Polar Surface Area:75.6
Heavy Atom Count:21
Complexity:374
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[(1,1-Dimethylethoxy)carbonyl]-3,5-difluoro-L-phenylalanine

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties

N-[(1,1-Dimethylethoxy)carbonyl]-3,5-difluoro-L-phenylalanine

SDS

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