AG00DGXH

Name: 3-(((Benzyloxy)carbonyl)amino)-3-methylbutanoic acid
Brand: Angene Chemical
SKU: AG00DGXH

51219-55-7 | 3-(((Benzyloxy)carbonyl)amino)-3-methylbutanoic acid

AG00DGXH

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CAS Number	51219-55-7
Catalog Number	AG00DGXH(AGN-PC-001S6F)
Chemical Name	3-(((Benzyloxy)carbonyl)amino)-3-methylbutanoic acid
IUPAC Name	3-methyl-3-(phenylmethoxycarbonylamino)butanoic acid
InChI	InChI=1S/C13H17NO4/c1-13(2,8-11(15)16)14-12(17)18-9-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,14,17)(H,15,16)
InChI Key	LVFPDQUAUOUBPO-UHFFFAOYSA-N
MDL Number	MFCD18206364
Molecular Formula	C13H17NO4
Molecular Weight	251.2784
SMILES	CC(NC(OCC1=CC=CC=C1)=O)(CC(O)=O)C
Synonyms	51219-55-7, 3-(((Benzyloxy)carbonyl)amino)-3-methylbutanoic acid, 3-(benzyloxycarbonylamino)-3-methylbutanoic acid, 3-{[(benzyloxy)carbonyl]amino}-3-methylbutanoic acid, SCHEMBL847723, DTXSID00561606, LVFPDQUAUOUBPO-UHFFFAOYSA-N, 7121AB, ZINC34317733, AKOS013998486, AJ-87945, ST2417320, FT-0706938, 3-benzyloxycarbonylamino-3-methyl-butyric acid, 3-Benzyloxycarbonylamino-3-methylbutanoic acid, W-3698, 3-methyl-3-(phenylmethoxycarbonylamino)butanoic acid, 3-Methyl-3-[(benzyloxycarbonyl)amino]butanoic acid, C13H17NO4, 3-(((Benzyloxy)carbonyl)amino)-3-methylbutanoicacid,

Complexity	295
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	251.116g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	251.282g/mol
Monoisotopic Mass	251.116g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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