AG000IXG

Name: 1H-Azepine-1,4-dicarboxylic acid, hexahydro-, 1-(phenylmethyl) ester
Brand: Angene Chemical
SKU: AG000IXG

1195256-01-9 | 1H-Azepine-1,4-dicarboxylic acid, hexahydro-, 1-(phenylmethyl) ester

AG000IXG

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CAS Number	1195256-01-9
Catalog Number	AG000IXG(AGN-PC-0WCKZ2)
Chemical Name	1H-Azepine-1,4-dicarboxylic acid, hexahydro-, 1-(phenylmethyl) ester
IUPAC Name	1-phenylmethoxycarbonylazepane-4-carboxylic acid
InChI	InChI=1S/C15H19NO4/c17-14(18)13-7-4-9-16(10-8-13)15(19)20-11-12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-11H2,(H,17,18)
InChI Key	JLWCNEUUHMLQAZ-UHFFFAOYSA-N
MDL Number	MFCD16658690
Molecular Formula	C15H19NO4
Molecular Weight	277.3157
SMILES	C(=O)(OCc1ccccc1)N1CCC(CCC1)C(=O)O
Synonyms	1195256-01-9, 1-[(BENZYLOXY)CARBONYL]AZEPANE-4-CARBOXYLIC ACID, 1-((Benzyloxy)carbonyl)azepane-4-carboxylic acid, 1-Cbz-azepan-4-carboxylic acid, SCHEMBL895480, JLWCNEUUHMLQAZ-UHFFFAOYSA-N, KS-000007MX, MFCD16658690, AKOS025291181, FCH2772322, PB28598, AK171573, AS-51104, CS-0052705, Q-3240,

Complexity	339
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	277.131g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	277.32g/mol
Monoisotopic Mass	277.131g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

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