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102014-77-7 | 3-Pyrrolidineacetic acid, 1-methyl-
CAS No: 102014-77-7 Catalog No: AG0006C5 MDL No:MFCD13563016
Product Description
Catalog Number:
AG0006C5
Chemical Name:
3-Pyrrolidineacetic acid, 1-methyl-
CAS Number:
102014-77-7
Molecular Formula:
C7H13NO2
Molecular Weight:
143.1836
MDL Number:
MFCD13563016
IUPAC Name:
2-(1-methylpyrrolidin-3-yl)acetic acid
InChI:
InChI=1S/C7H13NO2/c1-8-3-2-6(5-8)4-7(9)10/h6H,2-5H2,1H3,(H,9,10)
InChI Key:
GXZULSXLGWEQFS-UHFFFAOYSA-N
SMILES:
CN1CCC(C1)CC(=O)O
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.095g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
143.186g/mol
Monoisotopic Mass:
143.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.1
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