| CAS Number | 1156601-73-8 |
| Catalog Number | AG000GOU(AGN-PC-06O70I) |
| Chemical Name | 1H-Pyrazol-4-amine, 1-(2-pyrimidinyl)- |
| IUPAC Name | 1-pyrimidin-2-ylpyrazol-4-amine |
| InChI | InChI=1S/C7H7N5/c8-6-4-11-12(5-6)7-9-2-1-3-10-7/h1-5H,8H2 |
| InChI Key | YQMXNLJSYFTVOF-UHFFFAOYSA-N |
| MDL Number | MFCD12192741 |
| Molecular Formula | C7H7N5 |
| Molecular Weight | 161.1640 |
| SMILES | NC1=CN(C2=NC=CC=N2)N=C1 |
| Synonyms | 1-(pyrimidin-2-yl)-1H-pyrazol-4-amine,
1156601-73-8,
1-pyrimidin-2-ylpyrazol-4-amine,
SCHEMBL17076806,
9581AC,
MFCD12192741,
ZINC35731052,
AKOS009582190,
MCULE-4676979495,
NE31728,
AJ-92088,
1H-Pyrazol-4-amine, 1-(2-pyrimidinyl)-,
AM20080103,
FT-0745198,
ST24037671,
EN300-82519,
Z1250132723,
C7H7N5,
1-(2-pyrimidinyl)-1H-Pyrazol-4-amine,
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| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 161.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 161.168g/mol |
| Monoisotopic Mass | 161.07g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 69.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number