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Home > Encyclopedia > Phenylmethyl N-[(1S)-3-chloro-1-methyl-2-oxopropyl]carbamate

Phenylmethyl N-[(1S)-3-chloro-1-methyl-2-oxopropyl]carbamate

Phenylmethyl N-[(1S)-3-chloro-1-methyl-2-oxopropyl]carbamate structure

Phenylmethyl N-[(1S)-3-chloro-1-methyl-2-oxopropyl]carbamate 

structure
  • CAS No:

    41036-43-5

  • Formula:

    C12H14ClNO3

  • Chemical Name:

    Phenylmethyl N-[(1S)-3-chloro-1-methyl-2-oxopropyl]carbamate

  • Synonyms:

    Carbamic acid,N-[(1S)-3-chloro-1-methyl-2-oxopropyl]-,phenylmethyl ester;Carbamic acid,(3-chloro-1-methyl-2-oxopropyl)-,phenylmethyl ester,(S)-;Carbamic acid,[(1S)-3-chloro-1-methyl-2-oxopropyl]-,phenylmethyl ester;Phenylmethyl N-[(1S)-3-chloro-1-methyl-2-oxopropyl]carbamate;N-(Benzyloxycarbonyl)-L-alanine chloromethyl ketone;N-Benzyloxycarbonyl-L-alanyl chloromethylketone

Phenylmethyl N-[(1S)-3-chloro-1-methyl-2-oxopropyl]carbamate Basic Attributes

255.69746

255.70

DTXSID50194009

Characteristics

55.4

2.2

67 °C @ Solvent: Ethyl acetate, Hexane

Drug Information

benzyloxycarbonyl-Ala-chloromethyl ketone

Computed Properties

Molecular Weight:255.70
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:255.0662210
Monoisotopic Mass:255.0662210
Topological Polar Surface Area:55.4
Heavy Atom Count:17
Complexity:265
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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