3-(3,6-dihydro-2H-pyran-4-yl)benzoic acid, 95%

Name: 3-(3,6-dihydro-2H-pyran-4-yl)benzoic acid
Brand: Chempure

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CAS Number

1000016-95-4

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About this item

IUPAC name	3-(3,6-dihydro-2H-pyran-4-yl)benzoic acid
inchi	InChI=1S/C12H12O3/c13-12(14)11-3-1-2-10(8-11)9-4-6-15-7-5-9/h1-4,8H,5-7H2,(H,13,14)
inchi key	ZYHXFROVJMFLBV-UHFFFAOYSA-N
molecular formula	C12H12O3
synonyms	3-(3,6-dihydro-2H-pyran-4-yl)benzoic acid 1000016-95-4 3-(3,6-dihydro-2H-pyran-4-yl)benzoicacid SCHEMBL3107969 ZYHXFROVJMFLBV-UHFFFAOYSA-N

Computed Properties

Molecular Weight:	204.22 g/mol
XLogP3:	1.5
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	3
Rotatable Bond Count:	2
Exact Mass:	204.078644241 g/mol
Monoisotopic Mass:	204.078644241 g/mol
Topological Polar Surface Area:	46.5 Å²
Heavy Atom Count:	15
Formal Charge:	0
Complexity:	270
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

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Product No: AW9474

3-(3,6-dihydro-2H-pyran-4-yl)benzoic acid, 95%

Product No: AW9474

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