Hexadecanolide 98%

CAT: 0286-H03120-02Size: 50 gDry Ice: NoHazardous: No

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CAT#:0286-H03120-02Size:50 g

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CAS Number

109-29-5

Synonyms

16-Hydroxyhexadecanoic acid lactone; omega-Hexadecalactone; Juniperic acid lactone

Pictogram

07 - Irritant

UDF Signal Word

Warning

MDL Number

MFCD00039668

Hazard Statement

H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.

DOT Name

Not D.O.T.-Regulated

Precautions

P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Hexadecanolide

16-Hexadecanolide is a macrolide.

CAS Number	109-29-5
PubChem CID	7984
IUPAC Name	oxacycloheptadecan-2-one
Molecular Formula	C16H30O2
Molecular Weight	254.41
XLogP	6.3
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	18
Formal Charge	0
Complexity	201

SMILES

C1CCCCCCCC(=O)OCCCCCCC1

InChI

InChI=1S/C16H30O2/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-18-16/h1-15H2

InChIKey

LOKPJYNMYCVCRM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 109-29-5

CID: 7984

Formula: C16H30O2

MW: 254.41

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	254.41
XLogP3	6.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	254.224580195
Monoisotopic Mass	254.224580195
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	201
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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Alternative Products

Catalog	Name
HY-119392-01	16-Hexadecanolide

Hexadecanolide 98%

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