4-methyl-1,3-thiazole-2-carbaldehyde

4-methyl-1,3-thiazole-2-carbaldehyde

CAS: 13750-68-0

Formula: C5H5NOS

SMILES: CC1=CSC(C=O)=N1

IUPAC: 4-methyl-1,3-thiazole-2-carbaldehyde

InChI: InChI=1S/C5H5NOS/c1-4-3-8-5(2-7)6-4/h2-3H,1H3

Composition: C (47.23%), H (3.96%), N (11.02%), O (12.58%), S (25.21%)

Molar Mass: 127.16

Atom Count: 13

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	127.009184959
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	NYMCQLLAIMUVSY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	31.91
Topological Polar Surface Area	29.96
Polarizability	11.83
Ring Count	1
Rotatable Bond Count	1

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