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1353981-12-0 | 2-(3-Dimethylaminomethyl-pyrrolidin-1-yl)-ethylamine
CAS No: 1353981-12-0 Catalog No: AG01F8IB MDL No:
Product Description
Catalog Number:
AG01F8IB
Chemical Name:
2-(3-Dimethylaminomethyl-pyrrolidin-1-yl)-ethylamine
CAS Number:
1353981-12-0
Molecular Formula:
C9H21N3
Molecular Weight:
171.2831
IUPAC Name:
2-[3-[(dimethylamino)methyl]pyrrolidin-1-yl]ethanamine
InChI:
InChI=1S/C9H21N3/c1-11(2)7-9-3-5-12(8-9)6-4-10/h9H,3-8,10H2,1-2H3
InChI Key:
QYBLNMULDUNRBR-UHFFFAOYSA-N
SMILES:
NCCN1CCC(C1)CN(C)C
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.174g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.288g/mol
Monoisotopic Mass:
171.174g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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