AG00DASR

Name: 6-[(butylamino)carbonyl]-3-cyclohexene-1-carboxylic acid
Brand: Angene Chemical
SKU: AG00DASR

544451-69-6 | 6-[(butylamino)carbonyl]-3-cyclohexene-1-carboxylic acid

AG00DASR

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CAS Number	544451-69-6
Catalog Number	AG00DASR(AGN-PC-0WB4S1)
Chemical Name	6-[(butylamino)carbonyl]-3-cyclohexene-1-carboxylic acid
IUPAC Name	6-(butylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
InChI	InChI=1S/C12H19NO3/c1-2-3-8-13-11(14)9-6-4-5-7-10(9)12(15)16/h4-5,9-10H,2-3,6-8H2,1H3,(H,13,14)(H,15,16)
InChI Key	XLQXGWOPKIGCQT-UHFFFAOYSA-N
MDL Number	MFCD03379120
Molecular Formula	C12H19NO3
Molecular Weight	225.2842
SMILES	C1(CC=CCC1C(O)=O)C(NCCCC)=O
Synonyms	544451-69-6, 6-[(BUTYLAMINO)CARBONYL]-3-CYCLOHEXENE-1-CARBOXYLIC ACID, CHEMBRDG-BB 7228752, 6-(butylcarbamoyl)cyclohex-3-ene-1-carboxylic Acid, AC1NP23A, 6-(Butylcarbamoyl)cyclohex-3-enecarboxylic acid, CTK5A1040, DTXSID70408539, MFCD03379120, AKOS003872855, Y-0316, CHEMBRDG-BB7228752, CID5122769,

Complexity	286
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	225.136g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	225.288g/mol
Monoisotopic Mass	225.136g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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