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1419075-98-1 | 3-Pyrrolidinemethanamine, 1-methyl-, (3S)-
CAS No: 1419075-98-1 Catalog No: AG001HBX MDL No:MFCD23106376
Product Description
Catalog Number:
AG001HBX
Chemical Name:
3-Pyrrolidinemethanamine, 1-methyl-, (3S)-
CAS Number:
1419075-98-1
Molecular Formula:
C6H14N2
Molecular Weight:
114.1888
MDL Number:
MFCD23106376
IUPAC Name:
[(3S)-1-methylpyrrolidin-3-yl]methanamine
InChI:
InChI=1S/C6H14N2/c1-8-3-2-6(4-7)5-8/h6H,2-5,7H2,1H3/t6-/m0/s1
InChI Key:
BAOBZCAXECCBQL-LURJTMIESA-N
SMILES:
NC[C@@H]1CCN(C1)C
Properties
Complexity:
72.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
114.116g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
114.192g/mol
Monoisotopic Mass:
114.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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