2,4,6-Trimethylbenzophenon

CAT: 0127-OR1010025-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR1010025-01Size:25 g

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CAS Number

954-16-5

MDL Number

MFCD32263492

Purity

99%

Smiles

Cc1cc(C)c(C(=O)c2ccccc2)c(C)c1

Chemical Information

2,4,6-Trimethylbenzophenone

CAS Number	954-16-5
PubChem CID	70380
IUPAC Name	phenyl-(2,4,6-trimethylphenyl)methanone
Molecular Formula	C16H16O
Molecular Weight	224.30
XLogP	4.4
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	17
Formal Charge	0
Complexity	253

SMILES

CC1=CC(=C(C(=C1)C)C(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C16H16O/c1-11-9-12(2)15(13(3)10-11)16(17)14-7-5-4-6-8-14/h4-10H,1-3H3

InChIKey

HPAFOABSQZMTHE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 954-16-5

CID: 70380

Formula: C16H16O

MW: 224.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	224.30
XLogP3	4.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	224.120115130
Monoisotopic Mass	224.120115130
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	253
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
OR1009876-01	2,2,4,4,6,6-Hexamethylcyclotrisilazane
OR27962	2,2,4,4,6,6-Hexamethylheptane
OR75211-01	4,4,4',4',6,6,6',6'-Octamethyl-2,2'-bi (1,3,2-dioxaborinane)
OR1048813-01	4,4',6,6'-Tetramethyl-2,2'-bipyrimidine
OR1009883	2,2',6,6'-Tetramethyl-4,4'-biphenol
OR1027319-01	2,2',6,6'-Tetramethyl-4,4'-Bipyridine
OR91002-01	4,4',6,6'-Tetramethyl-2,2'-bipyridine
OR1092709-01	2,2',6,6'-Tetrachloro-4,4'-bipyridine
OR1030867-01	2,4,6-Trimethyl-2,4,6-Trivinylcyclotrisilazane
OR1023653-01	2,2,4,6,6-Pentamethylheptane

Catalog	Name
TRC-H295030-50MG	2,2',4,4',6,6'-Hexachlorobiphenyl
JH14558	2,2,4,4,6,6-Hexamethylcyclotrisilazane
AR-B07334-01	2,2'4,4',6,6'-Hexabromobiphenyl
FH102053-01	2,2,4,4,6,6-Hexakis (2,2-difluoroethoxy) -2,2,4,4,6,6-hexahydro-1,3,5,2,4,6-triazatriphosphorine
419427-01	2, 2, 4, 4, 6, 6-Hexakis (2, 2, 3, 3, 4, 4-hexafluorobutoxy) -2, 2, 4, 4, 6, 6-hexahydro-1, 3, 5, 2, 4, 6-Triazatriphosphorine
FH102721-01	2,2,4,4,6,6-Hexakis (2,2,3,3,4,4-hexafluorobutoxy) -2,2,4,4,6,6-hexahydro-1,3,5,2,4,6-triazatriphosphorine
TRC-H293978-10MG	2,2,4,4,6,6-Hexakis(2,2,3,3,4,4-hexafluorobutoxy)-2,2,4,4,6,6-hexahydro-1,3,5,2,4,6-Triazatriphosphorine
ZCA47248-01	2,2',3,4,4',6,6'-Heptachlorobiphenyl
289889-01	2,2',6,6'-Tetramethyl-4,4'-bipyridine
TRC-H281405-50MG	2,2',4,4',6,6'-Hexabromo-bibenzyl