Home Other Building Blocks 4-cyclopropyl-1-(pyrrolidin-3-yl)-1H-1,2,3-triazole dihydrochloride

4-cyclopropyl-1-(pyrrolidin-3-yl)-1H-1,2,3-triazole dihydrochloride

CAS No.:
2031269-60-8
Catalog Number:
AG01BUPW
Molecular Formula:
C9H16Cl2N4
Molecular Weight:
251.1561
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Product Description
Catalog Number:
AG01BUPW
Chemical Name:
4-cyclopropyl-1-(pyrrolidin-3-yl)-1H-1,2,3-triazole dihydrochloride
CAS Number:
2031269-60-8
Molecular Formula:
C9H16Cl2N4
Molecular Weight:
251.1561
MDL Number:
MFCD30179824
IUPAC Name:
4-cyclopropyl-1-pyrrolidin-3-yltriazole;dihydrochloride
InChI:
InChI=1S/C9H14N4.2ClH/c1-2-7(1)9-6-13(12-11-9)8-3-4-10-5-8;;/h6-8,10H,1-5H2;2*1H
InChI Key:
VLXKXJJQBHMLIX-UHFFFAOYSA-N
SMILES:
C1NCC(C1)n1nnc(c1)C1CC1.Cl.Cl
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.075g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
251.155g/mol
Monoisotopic Mass:
250.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties