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2-Butenoicacid,4-[[(1,1-dimethylethoxy)carbonyl]amino]-,(2E)-(9CI)

2-Butenoicacid,4-[[(1,1-dimethylethoxy)carbonyl]amino]-,(2E)-(9CI) structure

CAS No:
180913-22-8
Formula:
C9H15NO4
Chemical Name:
2-Butenoicacid,4-[[(1,1-dimethylethoxy)carbonyl]amino]-,(2E)-(9CI)
Synonyms:
(E)-4-((tert-Butoxycarbonyl)amino)but-2-enoic acid;4-((tert-Butoxycarbonyl)amino)but-2-enoic acid;trans 4-{[(tert-butoxy)carbonyl]amino}but-2-enoic acid;SCHEMBL10323475;SCHEMBL10323476;ZINC39091345;(E)-N-Boc-4-amino-2-butenoic Acid;AKOS027321570;4-(tert-Butoxycarbonylamino)-2-butenoic acid;(E)-4-(tertbutoxycarbonylamino)but-2-enoic acid

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2-Butenoicacid,4-[[(1,1-dimethylethoxy)carbonyl]amino]-,(2E)-(9CI) Basic Attributes

Molecular Weight：

201.22

Exact Mass：

201.1

Characteristics

PSA：

75.6

XLogP3：

0.7

Density：

1.132±0.06 g/cm3(Predicted)

Boiling Point：

373.4±35.0 °C(Predicted)

Safety Information

GHS Classification：

|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+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:201.22
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:201.10010796
Monoisotopic Mass:201.10010796
Topological Polar Surface Area:75.6
Heavy Atom Count:14
Complexity:240
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2E)-4-{[(TERT-BUTOXY)CARBONYL]AMINO}BUT-2-ENOIC ACID

CAS No.: 180913-22-8

Content: 99.00%

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Guide of 2-Butenoicacid,4-[[(1,1-dimethylethoxy)carbonyl]amino]-,(2E)-(9CI)

Basic Attributes
Characteristics
Safety Information
Computed Properties
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2-Butenoicacid,4-[[(1,1-dimethylethoxy)carbonyl]amino]-,(2E)-(9CI)

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