Basic information
- CAS
927676-52-6- Standard SMILES
CN1CCN(c2ccc(CNC(=O)OC(C)(C)C)cc2)CC1- InChIKey
GNPWLFHOGGEZQW-UHFFFAOYSA-N- Molecular formula
- C17H27N3O2
- Average molar mass
- 305.4 g/mol
- Monoisotopic mass
- 305.21032711
Names & identifiers
- Preferred name
- tert-Butyl 4-(4-methylpiperazin-1-yl)benzylcarbamate
- IUPAC
- tert-butyl N-[[4-(4-methylpiperazin-1-yl)phenyl]methyl]carbamate
- English name
- tert-Butyl 4-(4-Methylpiperazin-1-yl)benzylcarbaMate
- Molecular formula
- C17H27N3O2
- Molecular weight
- 305.42
Names & synonyms
tert-Butyl 4-(4-methylpiperazin-1-yl)benzylcarbamate927676-52-6tert-butyl N-[[4-(4-methylpiperazin-1-yl)phenyl]methyl]carbamateMFCD28144942tert-butyl N-{[4-(4-methylpiperazin-1-yl)phenyl]methyl}carbamateGNPWLFHOGGEZQW-UHFFFAOYSA-NSCHEMBL4487502DTXSID601151214AKOS024464806DS-3241DB-160305CS-0154391
Show more names
Carbamic acid, N-[[4-(4-methyl-1-piperazinyl)phenyl]methyl]-, 1,1-dimethylethyl ester
D97627F424848tert-Butyl4-(4-methylpiperazin-1-yl)benzylcarbamatetert-Butyl {[4-(4-methylpiperazin-1-yl)phenyl]methyl}carbamate1,1-Dimethylethyl N-[[4-(4-methyl-1-piperazinyl)phenyl]methyl]carbamate
Database identifiers
- CAS
927676-52-6- PubChem CID
- 69062408
- DTXSID
DTXSID601151214
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 351
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers9 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
Aladdin Scientific[email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
湖北偕丰医药科技有限公司2383948258 19172820304 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
2 records
Compound notes
Loading…