1-(3-chlorophenyl)prop-2-yn-1-ol

1-(3-chlorophenyl)prop-2-yn-1-ol

CAS: 29805-12-7

Formula: C9H7ClO

SMILES: OC(C#C)C1=CC=CC(Cl)=C1

IUPAC: 1-(3-chlorophenyl)prop-2-yn-1-ol

InChI: InChI=1/C9H7ClO/c1-2-9(11)7-4-3-5-8(10)6-7/h1,3-6,9,11H

Composition: C (64.88%), H (4.24%), Cl (21.28%), O (9.60%)

Molar Mass: 166.6

Atom Count: 18

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	166.0185425
Formal Charge	0
FSP3	0.11
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	BNPLJHLZNBBYAX-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.93
Topological Polar Surface Area	20.23
Polarizability	17.23
Ring Count	1
Rotatable Bond Count	1

Suppliers

Acrotein ChemBio Inc.,

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	29805-12-7		$103.68-$465.60$103.68$155.52$465.60