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ethyl 3-chloro-4,5-dimethoxybenzoate

ethyl 3-chloro-4,5-dimethoxybenzoate

Formula: C11H13ClO4

SMILES: CCOC(=O)C1=CC(Cl)=C(OC)C(OC)=C1

IUPAC: ethyl 3-chloro-4,5-dimethoxybenzoate

InChI: InChI=1S/C11H13ClO4/c1-4-16-11(13)7-5-8(12)10(15-3)9(6-7)14-2/h5-6H,4H2,1-3H3

Composition: C (54.00%), H (5.36%), Cl (14.49%), O (26.16%)

Molar Mass: 244.67

Atom Count: 29

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 244.0502366
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey QMYDUQAJBRFHMO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.56
Topological Polar Surface Area 44.76
Polarizability 23.59
Ring Count 1
Rotatable Bond Count 5

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C11H13ClO4 $1,460.00-$2,310.00$1,460.00$1,860.00$2,310.00
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