| CAS Number | 1185299-72-2 |
| Catalog Number | AG0090OW(AGN-PC-0WBSOP) |
| Chemical Name | C-(1-Methyl-1H-pyrazol-4-yl)-methylaminedihydrochloride |
| IUPAC Name | (1-methylpyrazol-4-yl)methanamine;dihydrochloride |
| InChI | InChI=1S/C5H9N3.2ClH/c1-8-4-5(2-6)3-7-8;;/h3-4H,2,6H2,1H3;2*1H |
| InChI Key | SELNOTDIMASHQX-UHFFFAOYSA-N |
| MDL Number | MFCD09879170 |
| Molecular Formula | C5H11Cl2N3 |
| Molecular Weight | 184.0669 |
| SMILES | NCC1=CN(C)N=C1.[H]Cl.[H]Cl |
| Synonyms | 1185299-72-2,
(1-Methyl-1H-pyrazol-4-yl)methanamine dihydrochloride,
c-(1-methyl-1h-pyrazol-4-yl)-methylamine dihydrochloride,
C-(1-Methyl-1H-pyrazol-4-yl)-methylaminedihydrochloride,
(1-METHYL-1H-PYRAZOL-4-YL)METHANAMINE 2HCL,
CTK7E6828,
KS-000003FO,
0373AD,
MFCD09879170,
AKOS015844967,
SB10382,
AK-78156,
AS-50662,
AX8222280,
CS-0053646,
(1-methylpyrazol-4-yl)methanamine;dihydrochloride,
(1-Methyl-1H-pyrazol-4-yl);methanamine dihydrochloride,
1-(1-Methyl-1H-pyrazol-4-yl)methanamine dihydrochloride,
C5H11Cl2N3,
Z-4828,
N/A,
|
| Complexity | 74.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.064g/mol |
| Monoisotopic Mass | 183.033g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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