Boc-Leu-Leu-OMe

CAT: 0127-OR1103120-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR1103120-01Size:1 g

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

15136-12-6

MDL Number

MFCD00237559

Purity

97%

Smiles

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

Chemical Information

Boc-leu-leu-ome

CAS Number	15136-12-6
PubChem CID	7073357
IUPAC Name	methyl (2S)-4-methyl-2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]pentanoate
Molecular Formula	C18H34N2O5
Molecular Weight	358.5
XLogP	3.6
Topological Polar Surface Area	93.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	11
Heavy Atom Count	25
Formal Charge	0
Complexity	455

SMILES

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

InChI

InChI=1S/C18H34N2O5/c1-11(2)9-13(20-17(23)25-18(5,6)7)15(21)19-14(10-12(3)4)16(22)24-8/h11-14H,9-10H2,1-8H3,(H,19,21)(H,20,23)/t13-,14-/m0/s1

InChIKey

LFRFWMCLWQNBFR-KBPBESRZSA-N

Chemical Structure

2D Structure

CAS: 15136-12-6

CID: 7073357

Formula: C18H34N2O5

MW: 358.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	358.5
XLogP3	3.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	11
Exact Mass	358.24677219
Monoisotopic Mass	358.24677219
Topological Polar Surface Area	93.7 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	455
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