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2-Propenoic acid, 2-methyl-, nonyl ester

HCID 98534
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
2696-43-7
Standard SMILES
C=C(C)C(=O)OCCCCCCCCC
InChIKey
LKEDKQWWISEKSW-UHFFFAOYSA-N
Molecular formula
C13H24O2
Average molar mass
212.33 g/mol
Monoisotopic mass
212.17763

Names & identifiers

Preferred name
2-Propenoic acid, 2-methyl-, nonyl ester
IUPAC
nonyl 2-methylprop-2-enoate
English name
N-NONYL METHACRYLATE
Molecular formula
C13H24O2
Molecular weight
212.33

Names & synonyms

2696-43-72-Propenoic acid, 2-methyl-, nonyl esterEINECS 220-270-5DTXSID1062596RefChem:89270DTXCID0037603LKEDKQWWISEKSW-UHFFFAOYSA-NNonyl methacrylatenonyl 2-methylprop-2-enoateN-NONYL METHACRYLATENonyl 2-methyl-2-propenoatemethacrylic acid nonyl ester
Show more names
methacrylicacidnonylester2-methylacrylic acid nonyl ester2-Propenoicacid,2-methyl-,nonylester
SCHEMBL236890SCHEMBL865981SCHEMBL1228491SCHEMBL27735819SCHEMBL27788183SCHEMBL27932128NS00028233

Database identifiers

CAS
2696-43-7
PubChem CID
98534
DTXSID
DTXSID1062596
EC Number
220-270-5
Nikkaji
J107.758I

Properties

Computed structural properties

XLogP
5.6
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
10
Heavy atoms
15
Formal charge
0
Complexity
185

Experimental & physicochemical properties

SpringerMaterials PropertiesViscosity

Physicochemical properties

Boiling point
85 · 85-87 °C(Press: 1.2 Torr)
Density
0.8796 g/ml · 0.8796g/ml
solubility
Insoluble in water, soluble in alcohol and oils
Odor
Pungent-herbaceous-ethereal, but sweet and warm odor
EPA Substance Registry System
2 · 2-Propenoic acid, 2-methyl-, nonyl ester (2696-43-7)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing Information2-Propenoic acid, 2-methyl-, nonyl ester: ACTIVE
Applications · 1 item

UsesN-nonyl methacrylate, developed in a range of esters for entirely different purpose (plastic and plexiglass) has been suggested for use in perfume compositions for its powerful lift and warm, ethereal character, blending excellently with Geranium, Lavender, Spike Lavender, etc. for detergent perfumes and similar type fragrances.

Suppliers5 total

上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]

Related reactions

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Compound notes

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