Methyl 10-undecenoate 96%

CAT: 0286-M30170-01Size: 25 mLDry Ice: NoHazardous: No

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CAT#:0286-M30170-01Size:25 mL

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CAS Number

5760-50-9

Synonyms

Methyl undecylenate; 10-Undecenoic acid methyl ester; Undecylenic acid methyl ester

Pictogram

07 - Irritant

UDF Signal Word

Warning

MDL Number

MFCD00016689

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

Methyl 9-undecenoate

Methyl 9-undecenoate is a fatty acid methyl ester.

CAS Number	5760-50-9
PubChem CID	6435903
IUPAC Name	methyl (E)-undec-9-enoate
Molecular Formula	C12H22O2
Molecular Weight	198.30
XLogP	3.9
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	9
Heavy Atom Count	14
Formal Charge	0
Complexity	162

SMILES

C/C=C/CCCCCCCC(=O)OC

InChI

InChI=1S/C12H22O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h3-4H,5-11H2,1-2H3/b4-3+

InChIKey

RHRCWCJKYPOGNT-ONEGZZNKSA-N

Chemical Structure

2D Structure

CAS: 5760-50-9

CID: 6435903

Formula: C12H22O2

MW: 198.30

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	198.30
XLogP3	3.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	9
Exact Mass	198.161979940
Monoisotopic Mass	198.161979940
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	162
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Methyl 10-undecenoate 96%

Chemical Information

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