Tert-butyl 4-(4-cyanopyridin-2-yl)piperazine-1-carboxylate

HCID 18525852
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
884507-31-7
Standard SMILES
CC(C)(C)OC(=O)N1CCN(c2cc(C#N)ccn2)CC1
InChIKey
SLBLBTKJSGRVTR-UHFFFAOYSA-N
Molecular formula
C15H20N4O2
Average molar mass
288.34 g/mol
Monoisotopic mass
288.15862588

Names & identifiers

Preferred name
Tert-butyl 4-(4-cyanopyridin-2-yl)piperazine-1-carboxylate
IUPAC
tert-butyl 4-(4-cyano-2-pyridinyl)piperazine-1-carboxylate
English name
tert-Butyl 4-(4-cyanopyrid-2-yl)piperazine-1-carboxylate
Molecular formula
C15H20N4O2
Molecular weight
288.34

Names & synonyms

884507-31-7tert-butyl 4-(4-cyanopyridin-2-yl)piperazine-1-carboxylatetert-butyl 4-(4-cyanopyrid-2-yl)piperazine-1-carboxylate1-N-Boc-4-(4-Cyanopyridin-2-yl)piperazineMFCD087414374-(4-Cyano-pyridin-2-yl)-piperazine-1-carboxylic acid tert-butyl ester1-Piperazinecarboxylic acid, 4-(4-cyano-2-pyridinyl)-, 1,1-dimethylethyl ester1-Piperazinecarboxylicacid, 4-(4-cyano-2-pyridinyl)-, 1,1-dimethylethyl esterorb3022602SCHEMBL26122945DTXSID90594605TPL0462
Show more names
Compound CC50616N1-BOC- 4-(4-CYANOPYRIDIN-2-YL)PIPERAZINE4-(4-CYANOPYRID-2-YL)PIPERAZINE, N1-BOC PROTECTED4-(4-Cyanopyridin-2-yl)piperazine, N1-BOC protected1,1-Dimethylethyl 4-(4-cyano-2-pyridinyl)-1-piperazinecarboxylate4-(4-Cyano-2-pyridinyl)-1-piperazinecarboxylic acid tert-butyl estertert-Butyl 4-(4-cyanopyrid-2-yl)piperazine-1-carboxylate ISO 9001：2015 REACH
SBB075510AKOS015941039MS-224821-Boc-4-(4-cyanopyridin-2-yl)piperazineDB-077298CS-0272861EN300-226174F048545

Database identifiers

CAS
884507-31-7
PubChem CID
18525852
DTXSID
DTXSID90594605

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
69.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
21

Physicochemical properties

Melting point
127 °C · 127 °C
Density
1.668 · 1.668
Hazard Codes
T
Risk Statements
25 · 25
Safety Statements
45 · 45
Hazard Note
Harmful

Safety & regulation

Safety data

risk_code
25
hazard_code
T
hazard_note
Harmful
safety_code
45

Chemistry & industry

Upstream & downstream products

Suppliers19 total

陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…