Spiro[chromane-2,1'-cyclohexan]-4-one

CAT: 0127-OR77847-02Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR77847-02Size:250 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

62756-20-1

MDL Number

MFCD18431738

Purity

98%

Smiles

C1CCC2(CC1)CC(=O)C3=CC=CC=C3O2

Chemical Information

3,4-Dihydrospiro[1-benzopyran-2,1'-cyclohexane]-4-one

CAS Number	62756-20-1
PubChem CID	11106781
IUPAC Name	spiro[3H-chromene-2,1'-cyclohexane]-4-one
Molecular Formula	C14H16O2
Molecular Weight	216.27
XLogP	3
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	16
Formal Charge	0
Complexity	278

SMILES

C1CCC2(CC1)CC(=O)C3=CC=CC=C3O2

InChI

InChI=1S/C14H16O2/c15-12-10-14(8-4-1-5-9-14)16-13-7-3-2-6-11(12)13/h2-3,6-7H,1,4-5,8-10H2

InChIKey

DBQLMDVZSFDTRL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 62756-20-1

CID: 11106781

Formula: C14H16O2

MW: 216.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	216.27
XLogP3	3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	216.115029749
Monoisotopic Mass	216.115029749
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	278
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

Catalog	Name
OR86536-01	6-Bromospiro[chromane-2,1'-cyclohexan]-4-one
OR1033448-01	Spiro[benzo[e][1,3]oxazine-2,1'-cyclohexan]-4 (3H) -one
OR1063261-01	Spiro[chroman-2,4'-piperidin]-4-one hydrochloride
OR77602-01	1'-Benzylspiro[chromane-2,4'-piperidin]-4-one
OR1064552-01	Spiro[chroman-2,4'-piperidine]
OR340125	2- (4-Nitrophenyl) cyclohexan-1-one
OR1054512-01	3- (2-Chloropropanoyl) spiro[benzo[e][1,3]oxazine-2,1'-cyclohexan]-4 (3H) -one
OR73008-01	Spiro[2.4]heptan-4-one
OR88483-01	4- (2-Butoxyethoxy) cyclohexan-1-one
OR89079	Spiro[cyclohexane-1,1'-isochroman]-4-one

Catalog	Name
EIA19241-01	3H-Spiro[2-benzofuran-1,1'-cyclohexan]-4'-one
JCA79893-01	2- (4-Fluorophenoxy) cyclohexan-1-one
sc-272498	Spiro- (cyclohexan-1,9'- (2,6-dibromo-fluoren) )
sc-280095	Spiro[1,3-benzodioxole-2,1'-cyclohexan]-5-amine
PAA19509-01	2- (4-Methylbenzenesulfonyl) cyclohexan-1-one
QMC33669-01	4- (Cyclohexyloxy) cyclohexan-1-one
RG-E140393-01	4- (methylamino) cyclohexan-1-one
DEA31905-01	4- (Pyridin-2-yl) cyclohexan-1-one
sc-340723A	2-[ (4-methylbenzene) sulfonyl]cyclohexan-1-one
RMC47808-01	4- (Cyclopentyloxy) cyclohexan-1-one