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ethyl 4-chloro-2-methoxy-5-methylbenzoate

ethyl 4-chloro-2-methoxy-5-methylbenzoate

Formula: C11H13ClO3

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

IUPAC: ethyl 4-chloro-2-methoxy-5-methylbenzoate

InChI: InChI=1S/C11H13ClO3/c1-4-15-11(13)8-5-7(2)9(12)6-10(8)14-3/h5-6H,4H2,1-3H3

Composition: C (57.78%), H (5.73%), Cl (15.50%), O (20.99%)

Molar Mass: 228.67

Atom Count: 28

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 228.055322
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey RRHKQRXLWGQTIN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 59.14
Topological Polar Surface Area 35.53
Polarizability 22.78
Ring Count 1
Rotatable Bond Count 4

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C11H13ClO3 $1,860.00-$3,630.00$1,860.00$2,750.00$3,630.00
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