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tert-Butyl 3-bromopropionate

tert-Butyl 3-bromopropionate structure

CAS No:
55666-43-8
Formula:
C7H13BrO2
Chemical Name:
tert-Butyl 3-bromopropionate
Synonyms:
Propanoic acid,3-bromo-,1,1-dimethylethyl ester;tert-Butyl 3-bromopropionate;2-(tert-Butoxycarbonyl)ethyl bromide;tert-Butyl 3-bromopropanoate;NSC 82471;3-Bromopropionic acid tert-butyl ester;3-Bromopropionic acid tert-butyl ester

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tert-Butyl 3-bromopropionate Basic Attributes

Molecular Weight：

209.08100

Exact Mass：

209.08

NSC Number：

82471

DSSTox ID：

DTXSID40292427

HScode：

2915900090

Characteristics

PSA：

26.30000

XLogP3：

2.11310

Density：

1.3g/cm3

Boiling Point：

88-90 °C @ Press: 2.5 Torr

Flash Point：

100.6ºC

Refractive Index：

n20/D 1.4470(lit.)

Safety Information

hazard class code：

R22; R36/37/38

safety instructions：

S26; S36/37

Marks：

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:209.08
XLogP3:1.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:208.00989
Monoisotopic Mass:208.00989
Topological Polar Surface Area:26.3
Heavy Atom Count:10
Complexity:115
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Propanoic acid,3-bromo-, 1,1-dimethylethyl ester

CAS No.: 55666-43-8

Content: 99.00%

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Guide of tert-Butyl 3-bromopropionate

Basic Attributes
Characteristics
Safety Information
Computed Properties
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