3-(3,4-dimethoxyphenyl)-1H-pyrazole

3-(3,4-dimethoxyphenyl)-1H-pyrazole

CAS: 154257-70-2

Formula: C11H12N2O2

SMILES: COC1=C(OC)C=C(C=C1)C1=NNC=C1

IUPAC: 3-(3,4-dimethoxyphenyl)-1H-pyrazole

InChI: InChI=1S/C11H12N2O2/c1-14-10-4-3-8(7-11(10)15-2)9-5-6-12-13-9/h3-7H,1-2H3,(H,12,13)

Composition: C (64.69%), H (5.92%), N (13.72%), O (15.67%)

Molar Mass: 204.229

Atom Count: 27

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	204.089877634
Formal Charge	0
FSP3	0.18
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	SKDIDNLXZGTGPW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.44
Topological Polar Surface Area	47.14
Polarizability	23.12
Ring Count	2
Rotatable Bond Count	3

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OTAVA LTD.

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95%	<10 Days	154257-70-2		$398.82-$589.43$398.82$494.62$589.43

MFCD02091527

Key Organics Ltd

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90%	<2 Days	154257-70-2		$51.35-$86.31$51.35$63.37$86.31