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1-Boc-3-cyanoazetidine-3-...

1-Boc-3-cyanoazetidine-3-... structure

CAS No:
1158759-45-5
Formula:
C10H14N2O4
Chemical Name:
1-Boc-3-cyanoazetidine-3-...
Synonyms:
1-BOC-3-CYANOAZETIDINE-3-CARBOXYLIC ACID;1-[(tert-butoxy)carbonyl]-3-cyanoazetidine-3-carboxylic acid;1-(TERT-BUTOXYCARBONYL)-3-CYANOAZETIDINE-3-CARBOXYLIC ACID;3-cyano-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidine-3-carboxylic acid;SCHEMBL13957351;MFCD12406595;ZINC95630139;AKOS025290006;PB13533;KS-0000078X

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1-Boc-3-cyanoazetidine-3-... Basic Attributes

Molecular Weight：

226.23

Exact Mass：

226.095

HScode：

2933990090

Characteristics

PSA：

90.6

XLogP3：

0.2

Density：

1.29±0.1 g/cm3(Predicted)

Boiling Point：

405.3±45.0 °C(Predicted)

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, 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:226.23
XLogP3:0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:226.09535693
Monoisotopic Mass:226.09535693
Topological Polar Surface Area:90.6
Heavy Atom Count:16
Complexity:368
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 1 pentanol; mg phosphate; what is the name of c9h16; hydrofluoric acid formula; potassium iodate; t-butyl chloride

Guide of 1-Boc-3-cyanoazetidine-3-...

Basic Attributes
Characteristics
Safety Information
Computed Properties

1-Boc-3-cyanoazetidine-3-...

SDS

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