Cbz-Ala-Ala-Ome

CAT: 0127-OR1041631-01Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-OR1041631-01Size:5 g

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CAS Number

2483-51-4

MDL Number

MFCD00191050

Purity

97%

Smiles

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

Chemical Information

N-[(Phenylmethoxy)carbonyl]-L-alanyl-L-alanine methyl ester

CAS Number	2483-51-4
PubChem CID	7019113
IUPAC Name	methyl (2S)-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoate
Molecular Formula	C15H20N2O5
Molecular Weight	308.33
XLogP	1.5
Topological Polar Surface Area	93.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	8
Heavy Atom Count	22
Formal Charge	0
Complexity	393

SMILES

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

InChI

InChI=1S/C15H20N2O5/c1-10(13(18)16-11(2)14(19)21-3)17-15(20)22-9-12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3,(H,16,18)(H,17,20)/t10-,11-/m0/s1

InChIKey

CUCAZZQPISJXOS-QWRGUYRKSA-N

Chemical Structure

2D Structure

CAS: 2483-51-4

CID: 7019113

Formula: C15H20N2O5

MW: 308.33

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	308.33
XLogP3	1.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	8
Exact Mass	308.13722174
Monoisotopic Mass	308.13722174
Topological Polar Surface Area	93.7 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	393
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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
OR1103128-01	H-Ala-Ala-OMe.HCl
OR1012184-01	Ac-Ala-Ome
OR1013328-01	Fmoc-Ala-Ome
OR1103173-01	Cbz-His-OMe
OR1003939-01	Bzl-D-ala-ome hcl
OR1026713-01	H-Ala-Gly-Ome Hydrochloride
OR1012470-01	Boc-3-Iodo-D-Ala-Ome
OR963306-01	H-Beta-chloro-ala-ome hydrochloride
OR36389-01	Fmoc-Ala-Ala-OH
OR471217	Ala-Ala-Asn-PAB