AG00IC87

Name: 1-Piperazinecarboxylic acid, 4-cyano-, phenylmethyl ester
Brand: Angene Chemical
SKU: AG00IC87

721450-32-4 | 1-Piperazinecarboxylic acid, 4-cyano-, phenylmethyl ester

AG00IC87

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CAS Number	721450-32-4
Catalog Number	AG00IC87(AGN-PC-0OH2MT)
Chemical Name	1-Piperazinecarboxylic acid, 4-cyano-, phenylmethyl ester
IUPAC Name	benzyl 4-cyanopiperazine-1-carboxylate
InChI	InChI=1S/C13H15N3O2/c14-11-15-6-8-16(9-7-15)13(17)18-10-12-4-2-1-3-5-12/h1-5H,6-10H2
InChI Key	YTPMYXBSXRTEJE-UHFFFAOYSA-N
MDL Number	MFCD28991988
Molecular Formula	C13H15N3O2
Molecular Weight	245.2771
SMILES	C(#N)N1CCN(CC1)C(=O)OCC1=CC=CC=C1
Synonyms	Benzyl 4-cyanopiperazine-1-carboxylate, 721450-32-4, SCHEMBL4588232, MFCD28991988, ZINC144847102, CS-0037104, 4-(Benzyloxycarbonyl)piperazine-1-carbonitrile, 1-Piperazinecarboxylic acid, 4-cyano-, phenylmethyl ester,

Complexity	322
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	245.116g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	245.282g/mol
Monoisotopic Mass	245.116g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	56.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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