Formula |
C14H13BrN6O |
IUPAC Name |
n-[4-[(6-aminopurin-9-yl)methyl]phenyl]-2-bromo-acetamide |
Molecular Mass |
361.197 g·mol−1 |
Heat of Formation |
195.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.09 ± 1.08 D |
Volume |
356.76 Å 3 |
Surface Area |
325.37 Å 2 |
HOMO Energy |
-8.88 ± 0.55 eV |
LUMO Energy |
-0.54 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 9-(4-bromoacetamidobenzyl)adenine
- n-(4-((6-amino-9h-purin-9-yl)methyl)phenyl)-2-bromoacetamide
- n-[4-[(6-amino-9-purinyl)methyl]phenyl]-2-bromoacetamide
- n-[4-[(6-aminopurin-9-yl)methyl]phenyl]-2-bromo-acetamide
- n-[4-[(6-aminopurin-9-yl)methyl]phenyl]-2-bromo-ethanamide
- n-[4-[(6-aminopurin-9-yl)methyl]phenyl]-2-bromoacetamide
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CAS Number(s) |
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InChIKey |
MLENUZNNXIORHN-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
O
Br
N
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