Formula |
C9H13Cl2N3O2 |
IUPAC Name |
5-[bis(2-chloroethyl)aminomethyl]-1h-pyrimidine-2,4-dione |
Molecular Mass |
266.124 g·mol−1 |
Heat of Formation |
-399.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.21 ± 1.08 D |
Volume |
296.51 Å 3 |
Surface Area |
266.85 Å 2 |
HOMO Energy |
-9.59 ± 0.55 eV |
LUMO Energy |
-0.87 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2,4(1h,3h)-pyrimidinedione, 5-((bis(2-chloroethyl)amino)methyl)-
- 5-[bis(2-chloroethyl)aminomethyl]uracil
- 5-bis(2-chloroethyl)aminomethyluracil
- thyminealkamine
|
InChIKey |
DSNDKLPCPVXPMQ-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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|
Elements |
H
C
N
O
Cl
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