2,2-Dimethyl-2H-chromene

CAT: 0127-OR1044669-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1044669-01Size:100 mg

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CAS Number

2513-25-9

Purity

95%

Smiles

CC1(C)C=CC2=CC=CC=C2O1

Chemical Information

2,2-Dimethyl-2H-1-benzopyran

CAS Number	2513-25-9
PubChem CID	75642
IUPAC Name	2,2-dimethylchromene
Molecular Formula	C11H12O
Molecular Weight	160.21
XLogP	3.3
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	193

SMILES

CC1(C=CC2=CC=CC=C2O1)C

InChI

InChI=1S/C11H12O/c1-11(2)8-7-9-5-3-4-6-10(9)12-11/h3-8H,1-2H3

InChIKey

SAXKWTPDZMBKSQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2513-25-9

CID: 75642

Formula: C11H12O

MW: 160.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	160.21
XLogP3	3.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	160.088815002
Monoisotopic Mass	160.088815002
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	193
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
OR1052856-01	2H-chromene
OR1062988-01	2,2-Dimethyl-2H-benzo[g]chromene-5,10-dione
PC102855-01	2,2-Dimethyl-6- (4,4,4-trifluorobutoxy) -2H-chromene
OR1013849-01	Methyl 6-Hydroxy-2,2-Dimethyl-2H-Benzo[H]Chromene-5-Carboxylate
OR95056-01	2-Methyl-2H-chromene-3-carbaldehyde
PC410224	3-Nitro-2- (trifluoromethyl) -2H-chromene
OR89243-01	2,2-Dimethyl-2H-chromen-5-ol
OR86069	2,2-Dimethyl-2H-chromen-6-amine
OR1042320-01	2- (Dimethoxymethyl) -2-methyl-6-nitro-2h-chromene
OR471019	6-Bromo-2H-chromene

Catalog	Name
HDA30504-01	6-Bromo-2,2-dimethyl-2H-chromene
GTR19252524-01	2,2-Dimethyl-2H-chromene-6-carbonitrile
UCA96440-01	2,2-Dimethyl-2H-chromene-6-carbaldehyde
sc-291201	6-Bromo-2,2-dimethyl-2H-chromene-5,8-dione
sc-311685	2,2-Dimethyl-1a,7b-dihydro-2H-oxireno[c]chromene
TBZ1653	Methyl 8-hydroxy-2,2-dimethyl-2H-chromene-6-carboxylate
TRC-H955023-750MG	2H-chromene
QDA32259-01	2-Oxo-2H-chromene-6-sulfonamide
UCA01565-01	2-Oxo-2H-chromene-3-carbothioamide
D105-5MG	6,7-Dimethoxy-2,2-dimethyl-3-chromene