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Home > Encyclopedia > 1,1-Dimethylethyl N-[3-(hydroxymethyl)-1-(phenylmethyl)-3-pyrrolidinyl]carbamate

1,1-Dimethylethyl N-[3-(hydroxymethyl)-1-(phenylmethyl)-3-pyrrolidinyl]carbamate

1,1-Dimethylethyl N-[3-(hydroxymethyl)-1-(phenylmethyl)-3-pyrrolidinyl]carbamate structure

1,1-Dimethylethyl N-[3-(hydroxymethyl)-1-(phenylmethyl)-3-pyrrolidinyl]carbamate 

structure
  • CAS No:

    475469-14-8

  • Formula:

    C17H26N2O3

  • Chemical Name:

    1,1-Dimethylethyl N-[3-(hydroxymethyl)-1-(phenylmethyl)-3-pyrrolidinyl]carbamate

  • Synonyms:

    Carbamic acid,N-[3-(hydroxymethyl)-1-(phenylmethyl)-3-pyrrolidinyl]-,1,1-dimethylethyl ester;Carbamic acid,[3-(hydroxymethyl)-1-(phenylmethyl)-3-pyrrolidinyl]-,1,1-dimethylethyl ester;1,1-Dimethylethyl N-[3-(hydroxymethyl)-1-(phenylmethyl)-3-pyrrolidinyl]carbamate;tert-Butyl [1-benzyl-3-(hydroxymethyl)pyrrolidin-3-yl]carbamate

1,1-Dimethylethyl N-[3-(hydroxymethyl)-1-(phenylmethyl)-3-pyrrolidinyl]carbamate Basic Attributes

306.4

306.40

DTXSID00448201

2933990090

Characteristics

61.80000

2.11

1.1±0.1 g/cm3

419.3±40.0 °C at 760 mmHg

207.4±27.3 °C

1.562

Safety Information

IRRITANT

1,1-Dimethylethyl N-[3-(hydroxymethyl)-1-(phenylmethyl)-3-pyrrolidinyl]carbamate Use and Manufacturing

1-Benzyl-3-(hydroxymethyl) 3-Boc-aminopyrrolidine is used in the preparation of piperidinyl pyrrolidinyl methanone compounds as renin inhibitors for the treatment of diseases associated with aspartic protease activity.

Computed Properties

Molecular Weight:306.4
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:306.19434270
Monoisotopic Mass:306.19434270
Topological Polar Surface Area:61.8
Heavy Atom Count:22
Complexity:375
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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