Palmitanilide

CAT: 0127-OR1078844-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR1078844-01Size:25 g

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

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CAS Number

6832-98-0

Synonyms

N-Palmitoylaniline / N-Phenylpalmitamide

MDL Number

MFCD00059287

Purity

>98.0%

Smiles

CCCCCCCCCCCCCCCC (=O) NC1=CC=CC=C1

Chemical Information

Hexadecanamide, N-phenyl-

has antibacterial activity; structure in first source

CAS Number	6832-98-0
PubChem CID	96171
IUPAC Name	N-phenylhexadecanamide
Molecular Formula	C22H37NO
Molecular Weight	331.5
XLogP	8.7
Topological Polar Surface Area	29.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	15
Heavy Atom Count	24
Formal Charge	0
Complexity	284

SMILES

CCCCCCCCCCCCCCCC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C22H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-22(24)23-21-18-15-14-16-19-21/h14-16,18-19H,2-13,17,20H2,1H3,(H,23,24)

InChIKey

VENJCACPSJGPCM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6832-98-0

CID: 96171

Formula: C22H37NO

MW: 331.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	331.5
XLogP3	8.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	15
Exact Mass	331.287514804
Monoisotopic Mass	331.287514804
Topological Polar Surface Area	29.1 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	284
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
T206511-01	Palmitanilide