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3-chloro-4-methylthiophene-2-carbaldehyde

3-chloro-4-methylthiophene-2-carbaldehyde

CAS: 1258283-00-9

Formula: C6H5ClOS

SMILES: CC1=CSC(C=O)=C1Cl

IUPAC: 3-chloro-4-methylthiophene-2-carbaldehyde

InChI: InChI=1S/C6H5ClOS/c1-4-3-9-5(2-8)6(4)7/h2-3H,1H3

Composition: C (44.87%), H (3.14%), Cl (22.07%), O (9.96%), S (19.96%)

Molar Mass: 160.62

Atom Count: 14

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 159.9749637
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey WXRJDMVPMNSPHU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 39.38
Topological Polar Surface Area 17.07
Polarizability 14.62
Ring Count 1
Rotatable Bond Count 1

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97% <7 Days 1258283-00-9 $740.52-$8,485.13$740.52$1,192.13$3,436.13$8,485.13
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95% 1 Day 1258283-00-9 $235.87-$2,476.66$235.87$412.78$825.55$2,476.66
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