2-Propenoic acid, 3-(dimethylamino)propyl ester

HCID 87693

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Basic information

CAS: 18526-07-3
Standard SMILES: C=CC(=O)OCCCN(C)C
InChIKey: UFQHFMGRRVQFNA-UHFFFAOYSA-N
Molecular formula: C8H15NO2
Average molar mass: 157.21 g/mol
Monoisotopic mass: 157.11027872

Names & identifiers

Preferred name: 2-Propenoic acid, 3-(dimethylamino)propyl ester
IUPAC: 3-(dimethylamino)propyl prop-2-enoate
English name: 3-(Dimethylamino)propyl acrylate
Molecular formula: C8H15NO2
Molecular weight: 157.21

Names & synonyms

3-(Dimethylamino)propyl acrylate2-Propenoic acid, 3-(dimethylamino)propyl ester5T4FPJ4PBT3-(n,n-dimethylamino)propyl acrylateEINECS 242-402-0DTXSID9066382RefChem:89279DTXCID003587318526-07-33-(dimethylamino)propyl prop-2-enoateUNII-5T4FPJ4PBTSCHEMBL21190

Show more names

3-(Dimethylamino)propyl acrylate 95%Propenoic acid 3-(dimethylamino)propyl ester2-propenoicacid,3-(dimethylamino)propylester

UFQHFMGRRVQFNA-UHFFFAOYSA-N3-(Dimethylamino)propyl acrylate, 95%3-(N ,N -Dimethylamino)propyl acrylate, N ,N -Dimethyl-3-aminopropyl acrylateDB-065527NS00026077H20634EN300-24794251

Database identifiers

CAS: 18526-07-3
PubChem CID: 87693
DTXSID: DTXSID9066382
UNII: 5T4FPJ4PBT
EC Number: 242-402-0
Nikkaji: J222.233G

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 6
Heavy atoms: 11
Formal charge: 0
Complexity: 132

Physicochemical properties

Boiling point: 167 °C · 167 °C (lit.)
Density: 0.928 g/mL · 0.928 g/mL at 25 °C (lit.)
refractive index: 20 · n20/D 1.44(lit.)
Flash point: 155 °F · 155 °F
storage temp.: 2 · 2-8°C
form: liquid
InChI: 1S/C8H15NO2/c1-4-8(10)11-7-5-6-9(2)3/h4H,1,5-7H2,2-3H3
InChIKey: UFQHFMGRRVQFNA-UHFFFAOYSA-N
SMILES: CN(C)CCCOC(=O)C=C
FDA UNII: 5 T4FPJ4PBT · 5T4FPJ4PBT
EPA Substance Registry System: 2 · 2-Propenoic acid, 3-(dimethylamino)propyl ester (18526-07-3)
UNSPSC Code: 12162002 · 12162002
NACRES: 23 · NA.23
Symbol(GHS): 5 · GHS05,GHS07
Signal word: Danger
Hazard statements: 302 · H302+H312+H332-H314

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

PPE: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
wgk: 3
tsca: TSCA listed
ridadr: UN 2735 8/PG 3
risk_code: 20/21/22-34
Signal word: Danger
Symbol(GHS): GHS05,GHS07
hazard_code: C
safety_code: 26-27-36/37/39-45
Storage Class: 8A - Combustible corrosive hazardous materials
Hazard statements: H302+H312+H332-H314
Hazard Classifications: Acute Tox. 4 OralSkin Corr. 1B
Precautionary statements: P261-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338

Chemistry & industry

Uses & manufacturing

General Manufacturing Information2-Propenoic acid, 3-(dimethylamino)propyl ester: ACTIVE

Suppliers19 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]

山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]

Aladdin Scientific[email protected]

安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]

上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]

Related reactions

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Compound notes

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