Name: Name:3-(chloromethyl)-4-methyl-5-(propan-2-yl)-4H-1,2,4-triazole hydrochloride
Brand: Angene
SKU: AG01A4QM
Rating: 90 (10 reviews)

3-(chloromethyl)-4-methyl-5-(propan-2-yl)-4H-1,2,4-triazole hydrochloride

CAS No.:

1432681-31-6

Catalog Number:

AG01A4QM

Molecular Formula:

C7H13Cl2N3

Molecular Weight:

210.1042

Catalog Number:

AG01A4QM

Chemical Name:

3-(chloromethyl)-4-methyl-5-(propan-2-yl)-4H-1,2,4-triazole hydrochloride

CAS Number:

1432681-31-6

Molecular Formula:

C7H13Cl2N3

Molecular Weight:

210.1042

MDL Number:

MFCD23701966

IUPAC Name:

3-(chloromethyl)-4-methyl-5-propan-2-yl-1,2,4-triazole;hydrochloride

InChI:

InChI=1S/C7H12ClN3.ClH/c1-5(2)7-10-9-6(4-8)11(7)3;/h5H,4H2,1-3H3;1H

InChI Key:

JEFYUBFAMVXLCM-UHFFFAOYSA-N

SMILES:

ClCc1nnc(n1C)C(C)C.Cl

Complexity:

129

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

209.049g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

210.102g/mol

Monoisotopic Mass:

209.049g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

30.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: