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853304-19-5

853304-19-5 | Pyrrolidine, 2-ethynyl-

CAS No: 853304-19-5 Catalog No: AG004P84 MDL No:MFCD11977330

Product Description

Catalog Number:
AG004P84
Chemical Name:
Pyrrolidine, 2-ethynyl-
CAS Number:
853304-19-5
Molecular Formula:
C6H9N
Molecular Weight:
95.1424
MDL Number:
MFCD11977330
IUPAC Name:
2-ethynylpyrrolidine
InChI:
InChI=1S/C6H9N/c1-2-6-4-3-5-7-6/h1,6-7H,3-5H2
InChI Key:
SODJJQTYBSNLPQ-UHFFFAOYSA-N
SMILES:
C#CC1CCCN1

Properties

Complexity:
98  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
95.073g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
95.145g/mol
Monoisotopic Mass:
95.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

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