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methyl 2-chloro-5-(methylamino)benzoate

methyl 2-chloro-5-(methylamino)benzoate

CAS: 1340437-11-7

Formula: C9H10ClNO2

SMILES: CNC1=CC(C(=O)OC)=C(Cl)C=C1

IUPAC: methyl 2-chloro-5-(methylamino)benzoate

InChI: InChI=1S/C9H10ClNO2/c1-11-6-3-4-8(10)7(5-6)9(12)13-2/h3-5,11H,1-2H3

Composition: C (54.15%), H (5.05%), Cl (17.76%), N (7.02%), O (16.03%)

Molar Mass: 199.63

Atom Count: 23

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 199.0400063
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey UIHYLRDOIKVBSW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.08
Topological Polar Surface Area 38.33
Polarizability 19.64
Ring Count 1
Rotatable Bond Count 3

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95% <2 Days 1340437-11-7 $189.75-$1,489.25$189.75$276.00$966.00$1,489.25
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