AG0082AS

Name: 2-[(Ethoxycarbonyl)amino]-3-methylbutanoic acid
Brand: Angene Chemical
SKU: AG0082AS

111421-95-5 | 2-[(Ethoxycarbonyl)amino]-3-methylbutanoic acid

AG0082AS

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CAS Number	111421-95-5
Catalog Number	AG0082AS(AGN-PC-00LJJJ)
Chemical Name	2-[(Ethoxycarbonyl)amino]-3-methylbutanoic acid
IUPAC Name	2-(ethoxycarbonylamino)-3-methylbutanoic acid
InChI	InChI=1S/C8H15NO4/c1-4-13-8(12)9-6(5(2)3)7(10)11/h5-6H,4H2,1-3H3,(H,9,12)(H,10,11)
InChI Key	ZAVWSNSSAROCIB-UHFFFAOYSA-N
MDL Number	MFCD09807004
Molecular Formula	C8H15NO4
Molecular Weight	189.2090
NSC Number	33498
SMILES	CCOC(NC(C(O)=O)C(C)C)=O
Synonyms	111421-95-5, DL-Valine, N-(ethoxycarbonyl)-, 2-[(ethoxycarbonyl)amino]-3-methylbutanoic acid, 2-((Ethoxycarbonyl)amino)-3-methylbutanoic acid, ACMC-20eukg, 2-(ethoxycarbonylamino)-3-methylbutanoic acid, AC1N9K9K, SCHEMBL193208, CTK0D3950, DTXSID90402377, AC1Q3597, NSC33498, NSC-33498, AKOS000153530, AKOS016344137, MCULE-2303756116, NE40119, NCGC00327933-01, 2-Ethoxycarbonylamino-3-methylbutyric acid, BB 0258901, EN300-36521, AB01322775-02, Z370706870, CID4362039, 2-(ethoxycarbonylamino)-3-methyl-butanoic Acid,

Complexity	191
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	189.1g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	189.211g/mol
Monoisotopic Mass	189.1g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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