| CAS Number | 1393179-35-5 |
| Catalog Number | AG001APW(AGN-PC-0WCMRO) |
| Chemical Name | 2-Amino-4-chloropyrimidine-5-carbonitrile |
| IUPAC Name | 2-amino-4-chloropyrimidine-5-carbonitrile |
| InChI | InChI=1S/C5H3ClN4/c6-4-3(1-7)2-9-5(8)10-4/h2H,(H2,8,9,10) |
| InChI Key | UPUMETVQYQSNGW-UHFFFAOYSA-N |
| MDL Number | MFCD27923125 |
| Molecular Formula | C5H3ClN4 |
| Molecular Weight | 154.5571 |
| SMILES | N#CC1=CN=C(N)N=C1Cl |
| Synonyms | 2-amino-4-chloropyrimidine-5-carbonitrile,
1393179-35-5,
AK143395,
2-amino-4-chloro-5-cyanopyrimidine,
SCHEMBL3356613,
DTXSID60857092,
UPUMETVQYQSNGW-UHFFFAOYSA-N,
MFCD27923125,
ZINC95929509,
AKOS022176190,
FCH2496496,
QC-6700,
2-AMino-4-chloro-pyriMidine-5-carbonitrile,
AJ-135494,
AX8224880,
5-Pyrimidinecarbonitrile, 2-amino-4-chloro-,
CS-0045829,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 154.005g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 154.557g/mol |
| Monoisotopic Mass | 154.005g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 75.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H332-H335
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Packing Group
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Precautionary statements
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P280-P305+P351+P338-P310
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UN Code
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Certificate of Analysis
Lot Number