Bz-Lys-OMe HCl

CAT: 0127-OR1102847-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1102847-01Size:250 mg

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CAS Number

14280-01-4

MDL Number

MFCD00235873

Purity

95%

Smiles

O=C (OC) [C@@H] (NC (C1=CC=CC=C1) =O) CCCCN.[H]Cl

Chemical Information

Methyl N~2~-benzoyllysinate--hydrogen chloride (1/1)

CAS Number	14280-01-4
PubChem CID	24194130
IUPAC Name	methyl 6-amino-2-benzamidohexanoate;hydrochloride
Molecular Formula	C14H21ClN2O3
Molecular Weight	300.78
Topological Polar Surface Area	81.4
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Heavy Atom Count	20
Formal Charge	0
Complexity	288

SMILES

COC(=O)C(CCCCN)NC(=O)C1=CC=CC=C1.Cl

InChI

InChI=1S/C14H20N2O3.ClH/c1-19-14(18)12(9-5-6-10-15)16-13(17)11-7-3-2-4-8-11;/h2-4,7-8,12H,5-6,9-10,15H2,1H3,(H,16,17);1H

InChIKey

VWDOEXQMKZJMLD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 14280-01-4

CID: 24194130

Formula: C14H21ClN2O3

MW: 300.78

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	300.78
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Exact Mass	300.1240702
Monoisotopic Mass	300.1240702
Topological Polar Surface Area	81.4 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	288
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes