4-(2,5-dihydroxyphenyl)butanoic acid

4-(2,5-dihydroxyphenyl)butanoic acid

CAS: 77267-97-1

Formula: C10H12O4

SMILES: OC(=O)CCCC1=C(O)C=CC(O)=C1

IUPAC: 4-(2,5-dihydroxyphenyl)butanoic acid

InChI: InChI=1S/C10H12O4/c11-8-4-5-9(12)7(6-8)2-1-3-10(13)14/h4-6,11-12H,1-3H2,(H,13,14)

Composition: C (61.22%), H (6.17%), O (32.62%)

Molar Mass: 196.202

Atom Count: 26

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	196.073558866
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	OJMDOCWYHKEGQO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.53
Topological Polar Surface Area	77.76
Polarizability	19.46
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	77267-97-1		$51.35-$524.40$51.35$63.37$86.31$524.40