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88015-31-0 | Pyrrolidine, 1-butyl-2-(1-methylethyl)-
CAS No: 88015-31-0 Catalog No: AG004JT6 MDL No:
Product Description
Catalog Number:
AG004JT6
Chemical Name:
Pyrrolidine, 1-butyl-2-(1-methylethyl)-
CAS Number:
88015-31-0
Molecular Formula:
C11H23N
Molecular Weight:
169.3070
IUPAC Name:
1-butyl-2-propan-2-ylpyrrolidine
InChI:
InChI=1S/C11H23N/c1-4-5-8-12-9-6-7-11(12)10(2)3/h10-11H,4-9H2,1-3H3
InChI Key:
ZKIWTJOOKJLWID-UHFFFAOYSA-N
SMILES:
CCCCN1CCCC1C(C)C
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.183g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.312g/mol
Monoisotopic Mass:
169.183g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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