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1-(1,1-Dimethylethyl) (2S,4S)-4-(phenylmethyl)-1,2-pyrrolidinedicarboxylate

1-(1,1-Dimethylethyl) (2S,4S)-4-(phenylmethyl)-1,2-pyrrolidinedicarboxylate structure

CAS No:
83623-78-3
Formula:
C17H23NO4
Chemical Name:
1-(1,1-Dimethylethyl) (2S,4S)-4-(phenylmethyl)-1,2-pyrrolidinedicarboxylate
Synonyms:
1,2-Pyrrolidinedicarboxylic acid,4-(phenylmethyl)-,1-(1,1-dimethylethyl) ester,(2S,4S)-;1,2-Pyrrolidinedicarboxylic acid,4-(phenylmethyl)-,1-(1,1-dimethylethyl) ester,(2S-cis)-;1-(1,1-Dimethylethyl) (2S,4S)-4-(phenylmethyl)-1,2-pyrrolidinedicarboxylate;4(S)-Benzyl-1-(tert-butoxycarbonyl)-2(S)-pyrrolidinecarboxylic acid

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

Molecular Weight：

305.36900

Exact Mass：

305.37

DSSTox ID：

DTXSID80451894

HScode：

2933990090

Characteristics

PSA：

66.84000

XLogP3：

2.87720

Density：

1.185g/cm3

Boiling Point：

447.9ºC

Flash Point：

224.7ºC

Refractive Index：

1.55

Computed Properties

Molecular Weight:305.4
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:305.16270821
Monoisotopic Mass:305.16270821
Topological Polar Surface Area:66.8
Heavy Atom Count:22
Complexity:409
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,4S)-4-(phenylmethyl)-1,2-pyrrolidinedicarboxylate

Basic Attributes
Characteristics
Computed Properties
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