Name: Name:methyl 2-amino-3-(1H-1,2,4-triazol-1-yl)propanoate dihydrochloride
Brand: Angene
SKU: AG01EI8P
Rating: 90 (10 reviews)

methyl 2-amino-3-(1H-1,2,4-triazol-1-yl)propanoate dihydrochloride

CAS No.:

2137505-54-3

Catalog Number:

AG01EI8P

Molecular Formula:

C6H12Cl2N4O2

Molecular Weight:

243.0911

Catalog Number:

AG01EI8P

Chemical Name:

methyl 2-amino-3-(1H-1,2,4-triazol-1-yl)propanoate dihydrochloride

CAS Number:

2137505-54-3

Molecular Formula:

C6H12Cl2N4O2

Molecular Weight:

243.0911

MDL Number:

MFCD31449519

IUPAC Name:

methyl 2-amino-3-(1,2,4-triazol-1-yl)propanoate;dihydrochloride

InChI:

InChI=1S/C6H10N4O2.2ClH/c1-12-6(11)5(7)2-10-4-8-3-9-10;;/h3-5H,2,7H2,1H3;2*1H

InChI Key:

SPCBQWIMHFGDCE-UHFFFAOYSA-N

SMILES:

COC(=O)C(Cn1ncnc1)N.Cl.Cl

Complexity:

164

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

242.034g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.088g/mol

Monoisotopic Mass:

242.034g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: