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3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one structure
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3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one

TL;DR: 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one (CAS 102271-78-3) is a chemical compound with molecular formula C13H15NO2 and molecular weight 217.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[[4-(dimethylamino)phenyl]methylidene]oxolan-2-one

Also Known As: 3-[(4-dimethylaminophenyl)methylidene]oxolan-2-one, 3-[[4-(dimethylamino)phenyl]methylidene]oxolan-2-one, 3-(4-(Dimethylamino)benzylidene)dihydro-2(3H)-furanone, 3-[4-(dimethylamino)benzylidene]dihydrofuran-2(3h)-one, 2(3H)-Furanone, 3-[[4-(dimethylamino)phenyl]methylene]dihydro-, (3E)-

CAS Number
102271-78-3
Molecular Formula
C13H15NO2
Molecular Weight
217.11028 g/mol
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Technical Specifications

Molecular FormulaC13H15NO2
Molecular Weight217.11028 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)29.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors3
Rotatable Bonds2
Exact Mass217.11028 Da
Heavy Atoms16
Complexity288.0
SMILESCN(C)C1=CC=C(C=C1)C=C2CCOC2=O
InChIKeyGQHNDMLBKQUGIZ-UHFFFAOYSA-N

Chemical Property Profile of 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one

XLogP
2.4
TPSA (Topological Polar Surface Area)
29.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
16
Complexity
288.0
Exact Mass
217.11028
Monoisotopic Mass
217.11028
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one

The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one. With a topological polar surface area (TPSA) of 29.5 Ų, 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one?

The CAS number of 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one is 102271-78-3.

What is the molecular formula of 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one?

The molecular formula of 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one is C13H15NO2.

What is the molecular weight of 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one?

The molecular weight of 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one is 217.11028 g/mol.

Where can I buy 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one?

You can request a quote for 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one?

Yes, CoreyChem provides custom synthesis services for 3-[[4-(Dimethylamino)phenyl]methylidene]oxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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