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2,4,5-trimethoxybenzoic acid

2,4,5-trimethoxybenzoic acid

CAS: 490-64-2

Formula: C10H12O5

SMILES: COC1=CC(OC)=C(C=C1OC)C(O)=O

IUPAC: 2,4,5-trimethoxybenzoic acid

InChI: InChI=1S/C10H12O5/c1-13-7-5-9(15-3)8(14-2)4-6(7)10(11)12/h4-5H,1-3H3,(H,11,12)

Composition: C (56.60%), H (5.70%), O (37.70%)

Molar Mass: 212.201

Atom Count: 27

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 212.068473486
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey KVZUCOGWKYOPID-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.7
Topological Polar Surface Area 64.99
Polarizability 20.3
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS UnitPrice
98% <14 Days 490-64-2 Quote Only
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Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 490-64-2 $19.55-$216.20$19.55$23.00$33.35$79.35$216.20
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98% <7 Days 490-64-2 $7.25-$165.60$7.25$12.42$39.33$165.60
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98% <5 Days 490-64-2 $23.96-$137.45$23.96$56.75$137.45
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