651923

Sigma-Aldrich

4-(Boc-piperazin-1-yl)-3-nitrobenzoic acid

97%

Synonym(s):
1-Boc-4-(4-carboxy-2-nitrophenyl)piperazine, 4-[(tert-Butoxycarbonyl)-piperazin-1-yl]-3-nitrobenzoic acid
Empirical Formula (Hill Notation):
C16H21N3O6
CAS Number:
Molecular Weight:
351.35
MDL number:
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

97%

mp

199-203 °C (dec.) (lit.)

SMILES string

CC(C)(C)OC(=O)N1CCN(CC1)c2ccc(cc2[N+]([O-])=O)C(O)=O

InChI

1S/C16H21N3O6/c1-16(2,3)25-15(22)18-8-6-17(7-9-18)12-5-4-11(14(20)21)10-13(12)19(23)24/h4-5,10H,6-9H2,1-3H3,(H,20,21)

InChI key

CYGRJUZYSXUAMM-UHFFFAOYSA-N

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Precautionary Statements

hazcat

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

storage_class_code

11 - Combustible Solids

WGK Germany

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US),Eyeshields,Gloves

Certificate of Analysis

Certificate of Origin

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