AG000HFB

Name: 2-(1-Boc-3-Piperidinylidene)acetonitrile
Brand: Angene Chemical
SKU: AG000HFB

1159982-27-0 | 2-(1-Boc-3-Piperidinylidene)acetonitrile

AG000HFB

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CAS Number	1159982-27-0
Catalog Number	AG000HFB(AGN-PC-0WA4W6)
Chemical Name	2-(1-Boc-3-Piperidinylidene)acetonitrile
IUPAC Name	tert-butyl 3-(cyanomethylidene)piperidine-1-carboxylate
InChI	InChI=1S/C12H18N2O2/c1-12(2,3)16-11(15)14-8-4-5-10(9-14)6-7-13/h6H,4-5,8-9H2,1-3H3
InChI Key	SNIXSVYUUCIRRS-UHFFFAOYSA-N
MDL Number	MFCD09953299
Molecular Formula	C12H18N2O2
Molecular Weight	222.2835
SMILES	CC(OC(N1CC(=CC#N)CCC1)=O)(C)C
Synonyms	1159982-27-0, 2-(1-BOC-3-PIPERIDINYLIDENE)ACETONITRILE, tert-Butyl 3-(cyanomethylene)piperidine-1-carboxylate, ACMC-2099rn, tert-butyl 3-(cyanomethylidene)piperidine-1-carboxylate, SCHEMBL19331833, CTK8A9308, DTXSID40742674, ANW-16929, 1-Piperidinecarboxylic acid, 3-(cyanomethylene)-, 1,1-dimethylethyl ester, N/A,

Complexity	344
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.137g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	222.288g/mol
Monoisotopic Mass	222.137g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	53.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	1
XLogP3	1.1

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited