2,5-dihydrothiophene-3-carbaldehyde

2,5-dihydrothiophene-3-carbaldehyde

CAS: 113772-16-0

Formula: C5H6OS

SMILES: O=CC1=CCSC1

IUPAC: 2,5-dihydrothiophene-3-carbaldehyde

InChI: InChI=1S/C5H6OS/c6-3-5-1-2-7-4-5/h1,3H,2,4H2

Composition: C (52.61%), H (5.30%), O (14.01%), S (28.08%)

Molar Mass: 114.16

Atom Count: 13

Heavy Atom Count: 7

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	114.013935987
Formal Charge	0
FSP3	0.4
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	PZWOFHNNNQBUOF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	32.41
Topological Polar Surface Area	17.07
Polarizability	12.11
Ring Count	1
Rotatable Bond Count	1

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