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  • Pyrrolidine,1-[(2S)-2-pyrrolidinylmethyl]
Name:Pyrrolidine,1-[(2S)-2-pyrrolidinylmethyl]
CAS No:51207-66-0

PRODUCT DESCRIPTION

【Name】
Pyrrolidine,1-[(2S)-2-pyrrolidinylmethyl]-
【CAS Registry number】
51207-66-0
【Synonyms】
Pyrrolidine,1-(2-pyrrolidinylmethyl)-, (S)-
(+)-1-(2-Pyrrolidinylmethyl)pyrrolidine
(2S)-1-(2-Pyrrolidinylmethyl)pyrrolidine
(2S)-2-((Pyrrolidin-1-yl)methyl)pyrrolidine
(2S)-2-(Pyrrolidin-1-ylmethyl)pyrrolidine
(S)-(+)-1-(2-Pyrrolidinomethyl)pyrrolidine
(S)-(+)-1-(2-Pyrrolidinylmethyl)pyrrolidine
(S)-(+)-1-[(Pyrrolidin-2-yl)methyl]pyrrolidine
(S)-(+)-2-(1-Pyrrolidinylmethyl)pyrrolidine
(S)-1-(2-Pyrrolidinylmethyl)pyrrolidine
(S)-1-(2-Pyrrolidinylmethyl)pyrrolidne
(S)-2-(1-Pyrrolidinylmethyl)pyrrolidine
(S)-2-[(Pyrrolidino)methyl]pyrrolidine
1-((2S)-Pyrrolidinylmethyl)pyrrolidine
1-[(2S)-2-pyrrolidinylmethyl]pyrrolidine
【Molecular Formula】
C9H18 N2 (Products with the same molecular formula)
【Molecular Weight】
182.31
【Inchi】
InChI=1/C9H18N2/c1-2-7-11(6-1)8-9-4-3-5-10-9/h9-10H,1-8H2/t9-/m0/s1
【InChIKey】
YLBWRMSQRFEIEB-UHFFFAOYSA-N
【Canonical SMILES】
C1CCN(C1)CC2CCCN2
【MOL File】
51207-66-0.mol

Chemical and Physical Properties

【Density】
0.975g/cm3
【Boiling Point】
265.8°Cat760mmHg
【Refractive Index】
n20/D 1.4871(lit.)
【Flash Point】
87.8°C
【Computed Properties】
Molecular Weight:154.25262 [g/mol]
Molecular Formula:C9H18N2
XLogP3-AA:0.9
H-Bond Donor:1
H-Bond Acceptor:2
Rotatable Bond Count:2
Exact Mass:154.146999
MonoIsotopic Mass:154.146999
Topological Polar Surface Area:15.3
Heavy Atom Count:11
Formal Charge:0
Complexity:119
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Donor Count:1
Feature 3D Cation Count:2
Feature 3D Ring Count:2
Effective Rotor Count:4
Conformer Sampling RMSD:0.6
CID Conformer Count:10

Safety and Handling

【Hazard Codes】
Xi
【Risk Statements】
36/38-36/37/38
【Safety Statements 】
26-36

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