Name: Name:(3S)-5-methyl-3-(pentanamidomethyl)hexanoic acid
Brand: Angene
SKU: AG01EKHE
Rating: 90 (10 reviews)

(3S)-5-methyl-3-(pentanamidomethyl)hexanoic acid

CAS No.:

1786905-72-3

Catalog Number:

AG01EKHE

Molecular Formula:

C13H25NO3

Molecular Weight:

243.3425

Catalog Number:

AG01EKHE

Chemical Name:

(3S)-5-methyl-3-(pentanamidomethyl)hexanoic acid

CAS Number:

1786905-72-3

Molecular Formula:

C13H25NO3

Molecular Weight:

243.3425

MDL Number:

MFCD20816262

IUPAC Name:

(3S)-5-methyl-3-[(pentanoylamino)methyl]hexanoic acid

InChI:

InChI=1S/C13H25NO3/c1-4-5-6-12(15)14-9-11(7-10(2)3)8-13(16)17/h10-11H,4-9H2,1-3H3,(H,14,15)(H,16,17)/t11-/m0/s1

InChI Key:

DNUHOTPMYZEPBP-NSHDSACASA-N

SMILES:

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

Complexity:

239

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.183g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.347g/mol

Monoisotopic Mass:

243.183g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4