2-Methylbenzofuran

CAT: 0127-OR928246-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR928246-01Size:100 mg

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CAS Number

4265-25-2

MDL Number

MFCD00005850

Purity

95%

Smiles

Cc1oc2ccccc2c1

Chemical Information

2-Methylbenzofuran

2-Methylcumarone is a member of benzofurans.

CAS Number	4265-25-2
PubChem CID	20263
IUPAC Name	2-methyl-1-benzofuran
Molecular Formula	C9H8O
Molecular Weight	132.16
XLogP	2.7
Topological Polar Surface Area	13.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	122

SMILES

CC1=CC2=CC=CC=C2O1

InChI

InChI=1S/C9H8O/c1-7-6-8-4-2-3-5-9(8)10-7/h2-6H,1H3

InChIKey

GBGPVUAOTCNZPT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4265-25-2

CID: 20263

Formula: C9H8O

MW: 132.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	132.16
XLogP3	2.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	132.057514874
Monoisotopic Mass	132.057514874
Topological Polar Surface Area	13.1 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	122
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
OR346653	5-Methylbenzofuran-2-carboxyamide
OR1033321	7-Methylbenzofuran
OR924946-01	5-Methylbenzofuran
OR1006752-01	4-Methylbenzofuran-2-carboxylic acid
OR77257-01	6-Methylbenzofuran-2-carboxylic acid
OR1054661-01	Ethyl 5-methylbenzofuran-2-carboxylate
OR79242-01	Methyl 7-methylbenzofuran-2-carboxylate
OR1013186-01	Ethyl 3-Methylbenzofuran-2-Carboxylate
OR93470-01	Methyl 5-methylbenzofuran-2-carboxylate
OR91665-01	Methyl 6-methylbenzofuran-2-carboxylate

Catalog	Name
sc-251784	2-Methylbenzofuran
S-2461	2-Methylbenzofuran - 1ML
sc-268082A	5-Iodo-2-methylbenzofuran
sc-308440	2-Methylbenzofuran-3-carbaldehyde
FCA58162-01	3-Methylbenzofuran-2-methanol
ECA58424-01	2-Methylbenzofuran-6-ol
ICA86348-01	3-Bromo-2-methylbenzofuran
sc-487082	2,3-Dihydro-2-methylbenzofuran
TAA44143-01	5-Methylbenzofuran
sc-226149	3-Methylbenzofuran