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1-(1,1-Dimethylethyl) (2S,4R)-4-amino-1,2-pyrrolidinedicarboxylate

1-(1,1-Dimethylethyl) (2S,4R)-4-amino-1,2-pyrrolidinedicarboxylate structure

CAS No:
132622-69-6
Formula:
C10H18N2O4
Chemical Name:
1-(1,1-Dimethylethyl) (2S,4R)-4-amino-1,2-pyrrolidinedicarboxylate
Synonyms:
1,2-Pyrrolidinedicarboxylic acid,4-amino-,1-(1,1-dimethylethyl) ester,(2S,4R)-;1,2-Pyrrolidinedicarboxylic acid,4-amino-,1-(1,1-dimethylethyl) ester,(2S-trans)-;1-(1,1-Dimethylethyl) (2S,4R)-4-amino-1,2-pyrrolidinedicarboxylate

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1-(1,1-Dimethylethyl) (2S,4R)-4-amino-1,2-pyrrolidinedicarboxylate Basic Attributes

Molecular Weight：

230.26100

Exact Mass：

230.26

DSSTox ID：

DTXSID80564610

Characteristics

PSA：

92.86000

XLogP3：

1.04590

Density：

1.232 g/cm3

Melting Point：

228-229 °C @ Solvent: Ethanol

Boiling Point：

371.1ºC at 760 mmHg

Refractive Index：

1.516

Safety Information

hazard class code：

R36/37/38

safety instructions：

S26; S36

Marks：

Computed Properties

Molecular Weight:230.26
XLogP3:-2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:230.12665706
Monoisotopic Mass:230.12665706
Topological Polar Surface Area:92.9
Heavy Atom Count:16
Complexity:298
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(1,1-Dimethylethyl) (2S,4R)-4-amino-1,2-pyrrolidinedicarboxylate

Basic Attributes
Characteristics
Safety Information
Computed Properties
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