1-Cyclopropoxy-2-fluorobenzene

CAT: 0926-TZB45926-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0926-TZB45926-01Size:100 mg

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CAS Number

1243459-26-8

MDL Number

MFCD17000412

Smiles

C1CC1OC2=CC=CC=C2F

Molecular Formula

C9H9FO

Molecular Weight

152.16 g/mol

Controlled

Chemical Information

1-Cyclopropoxy-2-fluorobenzene

CAS Number	1243459-26-8
PubChem CID	66584666
IUPAC Name	1-cyclopropyloxy-2-fluorobenzene
Molecular Formula	C9H9FO
Molecular Weight	152.16
XLogP	2.7
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	134

SMILES

C1CC1OC2=CC=CC=C2F

InChI

InChI=1S/C9H9FO/c10-8-3-1-2-4-9(8)11-7-5-6-7/h1-4,7H,5-6H2

InChIKey

JCRZTLWMOUVTFO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1243459-26-8

CID: 66584666

Formula: C9H9FO

MW: 152.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	152.16
XLogP3	2.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	152.063743068
Monoisotopic Mass	152.063743068
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	134
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
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DZB78441-01	1-Difluoromethanesulfonyl-2-fluorobenzene
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