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Benzo[b]fluoren-11-one

CAT: 0572-TRC-B411240-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-B411240-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3074-03-1
Hazard Statement
Not a hazardous substance according to GHS.
Purity
>95% (HPLC)
Smiles
C1=CC2=CC3=C(C=C2C=C1)C(=O)C4=CC=CC=C43
Molecular Formula
C17H10O
Molecular Weight
230.26
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Benzo[b]fluoren-11-one
CAS Number3074-03-1
PubChem CID18311
IUPAC Namebenzo[b]fluoren-11-one
Molecular FormulaC17H10O
Molecular Weight230.26
XLogP4.8
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count18
Formal Charge0
Complexity348
SMILES
C1=CC=C2C=C3C(=CC2=C1)C4=CC=CC=C4C3=O
InChI
InChI=1S/C17H10O/c18-17-14-8-4-3-7-13(14)15-9-11-5-1-2-6-12(11)10-16(15)17/h1-10H
InChIKey
MLMNDNOSVOKYMT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzo[b]fluoren-11-one
CAS: 3074-03-1
CID: 18311
Formula: C17H10O
MW: 230.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight230.26
XLogP34.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass230.073164938
Monoisotopic Mass230.073164938
Topological Polar Surface Area17.1 Ų
Heavy Atom Count18
Formal Charge0
Complexity348
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes