| Formula |
C18H21ClN4O2 |
| IUPAC Name |
2-amino-5-[3-[4-[(e)-4-chloro-3-oxo-but-1-enyl]anilino]propyl]-6-methyl-pyrimidin-1-ium-3-id-4-one |
| Molecular Mass |
360.838 g·mol−1 |
| Heat of Formation |
-141.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
13.90 ± 1.08 D |
| Volume |
425.03 Å 3 |
| Surface Area |
395.66 Å 2 |
| HOMO Energy |
-8.36 ± 0.55 eV |
| LUMO Energy |
-0.68 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-amino-5-[3-[[4-(4-chloro-3-keto-but-1-enyl)phenyl]amino]propyl]-6-methyl-1h-pyrimidin-4-one
- 2-amino-5-[3-[[4-(4-chloro-3-oxo-but-1-enyl)phenyl]amino]propyl]-6-methyl-1h-pyrimidin-4-one
- 2-amino-5-[3-[[4-(4-chloro-3-oxobut-1-enyl)phenyl]amino]propyl]-6-methyl-1h-pyrimidin-4-one
- 2-amino-5-[3-[[4-[(e)-4-chloro-3-keto-but-1-enyl]phenyl]amino]propyl]-6-methyl-1h-pyrimidin-4-one
- 2-amino-5-[3-[[4-[(e)-4-chloro-3-oxo-but-1-enyl]phenyl]amino]propyl]-6-methyl-1h-pyrimidin-4-one
- 2-amino-5-[3-[[4-[(e)-4-chloro-3-oxobut-1-enyl]phenyl]amino]propyl]-6-methyl-1h-pyrimidin-4-one
|
| InChIKey |
VOULAGCYJDNJNZ-RMKNXTFCSA-N |
| QR Code |
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| Links |
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
N
O
Cl
|
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