Home Carboxys tert-butyl 3-(aminomethyl)-1-methyl-1H-pyrazole-4-carboxylate

tert-butyl 3-(aminomethyl)-1-methyl-1H-pyrazole-4-carboxylate

CAS No.:
2060030-07-9
Catalog Number:
AG01B2O9
Molecular Formula:
C10H17N3O2
Molecular Weight:
211.2609
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Product Description
Catalog Number:
AG01B2O9
Chemical Name:
tert-butyl 3-(aminomethyl)-1-methyl-1H-pyrazole-4-carboxylate
CAS Number:
2060030-07-9
Molecular Formula:
C10H17N3O2
Molecular Weight:
211.2609
MDL Number:
MFCD30535593
IUPAC Name:
tert-butyl 3-(aminomethyl)-1-methylpyrazole-4-carboxylate
InChI:
InChI=1S/C10H17N3O2/c1-10(2,3)15-9(14)7-6-13(4)12-8(7)5-11/h6H,5,11H2,1-4H3
InChI Key:
GFAUXVDSWFWTQQ-UHFFFAOYSA-N
SMILES:
NCc1nn(cc1C(=O)OC(C)(C)C)C
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.132g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.265g/mol
Monoisotopic Mass:
211.132g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties