2,3,4-Trimethylbenzaldehyde

CAT: 0926-JBA34128-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-JBA34128-01Size:50 mg

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CAS Number

34341-28-1

MDL Number

MFCD01652197

Smiles

CC1=C (C (=C (C=C1) C=O) C) C

Molecular Formula

C10H12O

Molecular Weight

148.2 g/mol

Controlled

Chemical Information

2,3,4-Trimethylbenzaldehyde

CAS Number	34341-28-1
PubChem CID	2752597
IUPAC Name	2,3,4-trimethylbenzaldehyde
Molecular Formula	C10H12O
Molecular Weight	148.20
XLogP	2.5
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	142

SMILES

CC1=C(C(=C(C=C1)C=O)C)C

InChI

InChI=1S/C10H12O/c1-7-4-5-10(6-11)9(3)8(7)2/h4-6H,1-3H3

InChIKey

RPZOPDOUASNMNP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 34341-28-1

CID: 2752597

Formula: C10H12O

MW: 148.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	148.20
XLogP3	2.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	148.088815002
Monoisotopic Mass	148.088815002
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	142
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
FT71344-01	2,4,5-Trimethylbenzaldehyde
NDA17427-01	3-Bromo-2,4,6-trimethylbenzaldehyde
FM25213-01	4-Methoxy-2,3,6-trimethylbenzaldehyde
DCA71121-01	2,5-Dihydroxy-3,4,6-trimethylbenzaldehyde
DEA80842-01	2,5-Dimethoxy-3,4,6-trimethylbenzaldehyde
FA46741-01	4-Aminobutyric-2,2,3,3,4,4-D6
IEA15621	2,2,3,3,4,4,4-Heptafluorobutyl chloroformate
AAA67912	2,2,3,3,4,4-Hexafluorobutyric acid
MPA04953	Sodium 2,2,3,3,4,4-hexadeuterio-4-hydroxybutanoate
WCA16256	3- (2- (2,4-Dichlorophenyl) -2-hydroxyethyl) -3,4-imidazolidinedione

Catalog	Name
OR1044734-01	2,3,4-Trimethylbenzaldehyde
sc-231016	2,4,5-Trimethylbenzaldehyde
OR911451-01	2,4,6-Trimethylbenzaldehyde
282135-01	4-Methoxy-2,3,6-trimethylbenzaldehyde
OR1061213-01	4-Methoxy-2,3,5-trimethylbenzaldehyde
OR1098689	3-Bromo-2,4,6-trimethylbenzaldehyde
OR72254-01	3- (Hydroxymethyl) -2,4,6-trimethylbenzaldehyde
OR1047216-01	2,5-Dimethoxy-3,4,6-trimethylbenzaldehyde
M3292-51	4-Methoxy-2,3,6-trimethylbenzaldehyde-d3
OR1061494-01	(E) -2,4,6-Trimethylbenzaldehyde oxime