(Q72512609)

English

3-Bromo-N-[(tert-butoxy)carbonyl]phenylalanine

chemical compound

3-Bromo-N-[(1,1-dimethylethoxy)carbonyl]-DL-phenylalanine

In more languages

Statements

type of chemical entity

0 references

chemical compound

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343.04192015599995 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(R)-N-Boc-3-Bromophenylalanine

1 reference

based on heuristic

inferred from InChI

(S)-N-Boc-3-Bromophenylalanine

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₄H₁₈BrNO₄

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canonical SMILES

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

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CC(C)(C)OC(O)=N[C@@H](Cc1cccc(Br)c1)C(=O)O

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C14H18BrNO4/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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FBUDYESOPLBQIR-NSHDSACASA-N

1 reference

based on heuristic

inferred from InChI

CAS Registry Number

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1 reference

matched by identifier from

FBUDYESOPLBQIR-NSHDSACASA-N

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

FBUDYESOPLBQIR-NSHDSACASA-N

DSSTox substance ID

1 reference

matched by identifier from

FBUDYESOPLBQIR-NSHDSACASA-N

1 reference

matched by identifier from

FBUDYESOPLBQIR-NSHDSACASA-N

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