(Q72448891)

English

(S)-N-Boc-3-Chlorophenylalanine

chemical compound

3-Chloro-N-[(1,1-dimethylethoxy)carbonyl]-L-phenylalanine
(S)-2-[(tert-Butoxycarbonyl)amino]-3-(3-chlorophenyl)propionic acid
N-tert-Butoxycarbonyl-3-chlorophenyl-L-alanine

In more languages

Statements

type of chemical entity

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chemical compound

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299.09243573599997 dalton

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based on heuristic

inferred from isomeric SMILES

stereoisomer of

(R)-N-Boc-3-Chlorophenylalanine

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based on heuristic

inferred from InChI

chemical formula

C₁₄H₁₈ClNO₄

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canonical SMILES

CC(C)(C)OC(=O)NC(Cc1cccc(Cl)c1)C(=O)O

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC(=CC=C1)Cl)C(=O)O

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Identifiers

InChI=1S/C14H18ClNO4/c1-14(2,3)20-13(19)16-11(12(17)18)8-9-5-4-6-10(15)7-9/h4-7,11H,8H2,1-3H3,(H,16,19)(H,17,18)/t11-/m0/s1

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RCZHBTHQISEPPP-NSHDSACASA-N

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CAS Registry Number

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RCZHBTHQISEPPP-NSHDSACASA-N

CAS Common Chemistry

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=114873-03-9

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matched by identifier from

RCZHBTHQISEPPP-NSHDSACASA-N

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based on heuristic

inferred from InChIKey

matched by identifier from

RCZHBTHQISEPPP-NSHDSACASA-N

UniChem compound ID

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DSSTox substance ID

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matched by identifier from

RCZHBTHQISEPPP-NSHDSACASA-N

DSSTOX compound identifier

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