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102731-40-8 | 2-Propenoic acid, 2-methyl-, 2-(dimethylamino)ethyl ester, hydrofluoride (1:1)
CAS No: 102731-40-8 Catalog No: AG000880 MDL No:
Product Description
Catalog Number:
AG000880
Chemical Name:
2-Propenoic acid, 2-methyl-, 2-(dimethylamino)ethyl ester, hydrofluoride (1:1)
CAS Number:
102731-40-8
Molecular Formula:
C8H16FNO2
Molecular Weight:
177.2165
IUPAC Name:
2-(dimethylamino)ethyl 2-methylprop-2-enoate;hydrofluoride
InChI:
InChI=1S/C8H15NO2.FH/c1-7(2)8(10)11-6-5-9(3)4;/h1,5-6H2,2-4H3;1H
InChI Key:
ZYHXEVUJRBLFQR-UHFFFAOYSA-N
SMILES:
CN(CCOC(=O)C(=C)C)C.F
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.117g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.219g/mol
Monoisotopic Mass:
177.117g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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