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MEGA 12

CAT: 0926-FM111172Size: 5000 mgDry Ice: NoHazardous: No
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CAT#:0926-FM111172Size:5000 mg
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CAS Number
87246-72-8
Smiles
CCCCCCCCCCCC (=O) N (C) C[C@H] (O) [C@@H] (O) [C@H] (O) [C@H] (O) CO
Molecular Formula
C19H39NO6
Molecular Weight
377.52 g/mol
Controlled
No

Chemical Information

Lauroyl methyl glucamide
CAS Number87246-72-8
PubChem CID10948838
IUPAC NameN-methyl-N-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]dodecanamide
Molecular FormulaC19H39NO6
Molecular Weight377.5
XLogP1.7
Topological Polar Surface Area121
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count16
Heavy Atom Count26
Formal Charge0
Complexity355
SMILES
CCCCCCCCCCCC(=O)N(C)C[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O
InChI
InChI=1S/C19H39NO6/c1-3-4-5-6-7-8-9-10-11-12-17(24)20(2)13-15(22)18(25)19(26)16(23)14-21/h15-16,18-19,21-23,25-26H,3-14H2,1-2H3/t15-,16+,18+,19+/m0/s1
InChIKey
OGUKJRCPWCNIQL-QFHJOOASSA-N
Chemical Structure
2D Structure
2D structure of Lauroyl methyl glucamide
CAS: 87246-72-8
CID: 10948838
Formula: C19H39NO6
MW: 377.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight377.5
XLogP31.7
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count16
Exact Mass377.27773796
Monoisotopic Mass377.27773796
Topological Polar Surface Area121 Ų
Heavy Atom Count26
Formal Charge0
Complexity355
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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