1,1-bis(4-methoxyphenyl)prop-2-yn-1-ol

1,1-bis(4-methoxyphenyl)prop-2-yn-1-ol

CAS: 101597-25-5

Formula: C17H16O3

SMILES: COC1=CC=C(C=C1)C(O)(C#C)C1=CC=C(OC)C=C1

IUPAC: 1,1-bis(4-methoxyphenyl)prop-2-yn-1-ol

InChI: InChI=1S/C17H16O3/c1-4-17(18,13-5-9-15(19-2)10-6-13)14-7-11-16(20-3)12-8-14/h1,5-12,18H,2-3H3

Composition: C (76.10%), H (6.01%), O (17.89%)

Molar Mass: 268.312

Atom Count: 36

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	268.109944375
Formal Charge	0
FSP3	0.18
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	RFNDMLXNYMQMGN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.75
Topological Polar Surface Area	38.69
Polarizability	29.99
Ring Count	2
Rotatable Bond Count	4

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