Home Aminos 3-(4-amino-1-methyl-1H-pyrazol-5-yl)propanoic acid dihydrochloride

3-(4-amino-1-methyl-1H-pyrazol-5-yl)propanoic acid dihydrochloride

CAS No.:
2138021-28-8
Catalog Number:
AG01ELMB
Molecular Formula:
C7H13Cl2N3O2
Molecular Weight:
242.1030
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Product Description
Catalog Number:
AG01ELMB
Chemical Name:
3-(4-amino-1-methyl-1H-pyrazol-5-yl)propanoic acid dihydrochloride
CAS Number:
2138021-28-8
Molecular Formula:
C7H13Cl2N3O2
Molecular Weight:
242.1030
MDL Number:
MFCD31558775
IUPAC Name:
3-(4-amino-2-methylpyrazol-3-yl)propanoic acid;dihydrochloride
InChI:
InChI=1S/C7H11N3O2.2ClH/c1-10-6(2-3-7(11)12)5(8)4-9-10;;/h4H,2-3,8H2,1H3,(H,11,12);2*1H
InChI Key:
CWQHZSBTRBJBJV-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1c(N)cnn1C.Cl.Cl
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.038g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
242.1g/mol
Monoisotopic Mass:
241.038g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties