Z-Leu-methyl ester

CAT: 0024-sc-296834ASize: 25 gDry Ice: NoHazardous: No

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CAT#:0024-sc-296834ASize:25 g

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CAS Number

51021-87-5

Chemical Information

(S)-Methyl 2-(((benzyloxy)carbonyl)amino)-4-methylpentanoate

CAS Number	51021-87-5
PubChem CID	2063832
IUPAC Name	methyl (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate
Molecular Formula	C15H21NO4
Molecular Weight	279.33
XLogP	3.1
Topological Polar Surface Area	64.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Heavy Atom Count	20
Formal Charge	0
Complexity	311

SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C15H21NO4/c1-11(2)9-13(14(17)19-3)16-15(18)20-10-12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3,(H,16,18)/t13-/m0/s1

InChIKey

TXGKPHCJHIILKF-ZDUSSCGKSA-N

Chemical Structure

2D Structure

CAS: 51021-87-5

CID: 2063832

Formula: C15H21NO4

MW: 279.33

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	279.33
XLogP3	3.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Exact Mass	279.14705815
Monoisotopic Mass	279.14705815
Topological Polar Surface Area	64.6 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	311
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-475104	Z-β-alanine methyl ester
sc-296759A	Z-glycine methyl ester
sc-296759	Z-glycine methyl ester
sc-474327	Z-Leu-Leu-OH
sc-286924	Z-L-phenylalanine methyl ester
sc-286900	Z-L-alanine methyl ester
sc-286900A	Z-L-alanine methyl ester
sc-286915	Z-L-histidine methyl ester
sc-296795A	Z-L-glutamine methyl ester
sc-286915A	Z-L-histidine methyl ester

Catalog	Name
TRC-E565310-5MG	(Z,Z)-Epalrestat Methyl Ester
469042	(Z, Z) -Epalrestat Methyl Ester
273890-01	Z-dehydroalanine methyl ester
281466-01	Z-Leucine methyl ester
260790-01	Z-L-alanine methyl ester
468965-01	Z-DL-Serine methyl ester
447804-01	(E, Z) -Epalrestat Methyl Ester
TRC-E565305-2.5MG	(E,Z)-Epalrestat Methyl Ester
283888-01	Z-L-methionine methyl ester
260788-01	Z-beta-alanine methyl ester