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42980-61-0 | Ethyl 2-Methyl-3-(pyrrolidin-1-yl)propanoate
CAS No: 42980-61-0 Catalog No: AG01FARY MDL No:MFCD12922643
Product Description
Catalog Number:
AG01FARY
Chemical Name:
Ethyl 2-Methyl-3-(pyrrolidin-1-yl)propanoate
CAS Number:
42980-61-0
Molecular Formula:
C10H19NO2
Molecular Weight:
185.2634
MDL Number:
MFCD12922643
IUPAC Name:
ethyl 2-methyl-3-pyrrolidin-1-ylpropanoate
InChI:
InChI=1S/C10H19NO2/c1-3-13-10(12)9(2)8-11-6-4-5-7-11/h9H,3-8H2,1-2H3
InChI Key:
ZTPCGCDBGYYBLR-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(CN1CCCC1)C
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.142g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.267g/mol
Monoisotopic Mass:
185.142g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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