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2-chloro-6-methoxybenzoic acid

2-chloro-6-methoxybenzoic acid

CAS: 3260-89-7

Formula: C8H7ClO3

SMILES: COC1=CC=CC(Cl)=C1C(O)=O

IUPAC: 2-chloro-6-methoxybenzoic acid

InChI: InChI=1S/C8H7ClO3/c1-12-6-4-2-3-5(9)7(6)8(10)11/h2-4H,1H3,(H,10,11)

Composition: C (51.50%), H (3.78%), Cl (19.00%), O (25.72%)

Molar Mass: 186.59

Atom Count: 19

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 186.0083718
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey JUOHBAJZQDTICO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.58
Topological Polar Surface Area 46.53
Polarizability 17.15
Ring Count 1
Rotatable Bond Count 2

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Molecule Market Select
Purity LeadTime CAS UnitPrice
98% <14 Days 3260-89-7 Quote Only
Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 3260-89-7 $51.35-$86.31$51.35$63.37$86.31
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Struchem co.,ltd
Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 3260-89-7 $462.00-$738.00$462.00$738.00
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Chemcia Scientific, LLC
Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 3260-89-7 $120.75$120.75
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