Bz-Dl-Leu-OH

CAT: 0127-OR1023688-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR1023688-01Size:1 g

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

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CAS Number

17966-67-5

Synonyms

2-benzamido-4-methylpentanoic acid

Purity

98%

Smiles

CC(C)CC(C(=O)O)NC(=O)C1=CC=CC=C1

Chemical Information

N-Benzoyl-DL-leucine

CAS Number	17966-67-5
PubChem CID	294887
IUPAC Name	2-benzamido-4-methylpentanoic acid
Molecular Formula	C13H17NO3
Molecular Weight	235.28
XLogP	2.5
Topological Polar Surface Area	66.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	17
Formal Charge	0
Complexity	270

SMILES

CC(C)CC(C(=O)O)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H17NO3/c1-9(2)8-11(13(16)17)14-12(15)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,14,15)(H,16,17)

InChIKey

POLGZPYHEPOBFG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 17966-67-5

CID: 294887

Formula: C13H17NO3

MW: 235.28

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	235.28
XLogP3	2.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	235.12084340
Monoisotopic Mass	235.12084340
Topological Polar Surface Area	66.4 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	270
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	1
Compound Is Canonicalized	Yes