7-Pentadecanone

CAT: 0127-OR1045763-02Size: 250 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR1045763-02Size:250 mg

Selected

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

Quick Request Actions

CAS Number

6064-38-6

MDL Number

MFCD00027335

Purity

95%

Smiles

CCCCCCC(CCCCCCCC)=O

Chemical Information

7-Pentadecanone

CAS Number	6064-38-6
PubChem CID	292625
IUPAC Name	pentadecan-7-one
Molecular Formula	C15H30O
Molecular Weight	226.40
XLogP	6.2
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	12
Heavy Atom Count	16
Formal Charge	0
Complexity	152

SMILES

CCCCCCCCC(=O)CCCCCC

InChI

InChI=1S/C15H30O/c1-3-5-7-9-10-12-14-15(16)13-11-8-6-4-2/h3-14H2,1-2H3

InChIKey

VUXXXYMMZBAUSE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6064-38-6

CID: 292625

Formula: C15H30O

MW: 226.40

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	226.40
XLogP3	6.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	12
Exact Mass	226.229665576
Monoisotopic Mass	226.229665576
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	152
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
BUP10889	2-Pentadecanone
OR1025197-01	7- (Iodomethyl) pentadecane
OR1012046-01	7- (Bromomethyl) Pentadecane
OR1055710-01	Pentadecane-7,9-dione
OR01801	7-Bromooct-7-enenitrile
OR54331-01	7-Azaindole 7-oxide
BUP06642-01	7-Cyano-7-deazaguanine
OR2959	7-Chlorooct-7-enenitrile
OR1027958-01	7-Methyloctyl 7-Methyloctanoate
OR01806	7-Methyloct-7-enenitrile