AG01BCUT

Name: tert-butyl N-[(3-cyanophenyl)methyl]carbamate
Brand: Angene Chemical
SKU: AG01BCUT

916213-93-9 | tert-butyl N-[(3-cyanophenyl)methyl]carbamate

AG01BCUT

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CAS Number	916213-93-9
Catalog Number	AG01BCUT
Chemical Name	tert-butyl N-[(3-cyanophenyl)methyl]carbamate
IUPAC Name	tert-butyl N-[(3-cyanophenyl)methyl]carbamate
InChI	InChI=1S/C13H16N2O2/c1-13(2,3)17-12(16)15-9-11-6-4-5-10(7-11)8-14/h4-7H,9H2,1-3H3,(H,15,16)
InChI Key	NPPAYBVYRFLZMY-UHFFFAOYSA-N
MDL Number	MFCD14635695
Molecular Formula	C13H16N2O2
Molecular Weight	232.2783
SMILES	CC(OC(NCC1=CC(C#N)=CC=C1)=O)(C)C
Synonyms	tert-butyl 3-cyanobenzylcarbamate, 916213-93-9, SCHEMBL352314, NPPAYBVYRFLZMY-UHFFFAOYSA-N, tert-butyl (3-cyanobenzyl)carbamate, ZINC51668058, AKOS011597409, DA-01183, FT-0724248, tert-butyl N-[(3-cyanophenyl)methyl]carbamate, N-(3-Cyanobenzyl)carbamic acid tert-butyl ester,

Complexity	311
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	232.121g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	232.283g/mol
Monoisotopic Mass	232.121g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	62.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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