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5655-01-6,MFCD09832196
Catalog No.:AA003JG4
5655-01-6 | 3H-Pyrrolo[3,2-d]pyrimidin-4(5h)-one
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1g
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$89.00   $62.00
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  • Technical Information
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Technical Information
Catalog Number:
AA003JG4
Chemical Name:
3H-Pyrrolo[3,2-d]pyrimidin-4(5h)-one
CAS Number:
5655-01-6
Molecular Formula:
C6H5N3O
Molecular Weight:
135.1234
MDL Number:
MFCD09832196
IUPAC Name:
3,5-dihydropyrrolo[3,2-d]pyrimidin-4-one
InChI:
InChI=1S/C6H5N3O/c10-6-5-4(1-2-7-5)8-3-9-6/h1-3,7H,(H,8,9,10)
InChI Key:
UWMXUDUWVFWJPX-UHFFFAOYSA-N
SMILES:
O=c1nc[nH]c2c1[nH]cc2
Properties
Computed Properties
 
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.043g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
135.126g/mol
Monoisotopic Mass:
135.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  

Synonyms
 
9-deazahypoxanthine 
5655-01-6 
1H,4H,5H-pyrrolo[3,2-d]pyrimidin-4-one 
3,5-Dihydro-pyrrolo[3,2-d]pyrimidin-4-one 
UWMXUDUWVFWJPX-UHFFFAOYSA-N 
AK-24175 
3,5-Dihydropyrrolo[3,2-d]pyrimidin-4-one 
9HX 
4H-Pyrrolo[3,2-d]pyrimidin-4-one, 1,5-dihydro- 
3,5-Dihydropyrrolo(3,2-d)pyrimidin-4-one 
PubChem23147 
AC1L9JBO 
1H-Pyrrolo[3,2-d]pyrimidin-4(5H)-one 
3H,4H,5H-pyrrolo[3,2-d]pyrimidin-4-one 
SCHEMBL1056424 
SCHEMBL1056425 
CHEMBL1230671 
CTK1G8087 
CTK4I1371 
CTK8A0877 
CTK8D4100 
1i80 
BCP28322 
5H-Pyrrolo[3,2-d]pyrimidin-4-ol 
CS-M1569 
3H-Pyrrolo[3,2-d]pyrimidin-4-ol 
4-hydroxypyrrolo-[3,2-d]pyrimidine 
AB2818 
ANW-52269 
MFCD09832196 
QC-378 
ZINC12504135 
AKOS000265724 
AKOS006342700 
3H-pyrrolo[3,2-d]pyrimidin-4(5H)-one 
AKOS015918379 
3H,5H-Pyrrolo[3,2-d]pyrimidin-4one 
ACN-025617 
DB04095 
DS-0320 
FCH2164363 
HP21607 
PB28030 
RP20185 
KS-000002D4 
1,5-DIHYDRO-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE 
3H,5H-Pyrrolo[3,2-d]pyrimidin-4-one 
AJ-62458 
BR-24175 
SC-66072 
3H-Pyrrolo[3,2-d]pyrimidine-4(5H)-one 
1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one 
3,5-Dihydro-pyrrolo[3,2-dpyrimidin-4-one 
AB0081660 
AX8054901 
4CH-014435 
9-DEAZAHYPOXANTHINE 
AM20100041 
AM20100393 
BB 0261004 
FT-0647791 
FT-0731102 
W7018 
Y6345 
S-6236 
Z-4984 
Z-8470 
39455-99-7 
3,5-Dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one # 
I03-0582 
I14-7975 
J-511337 
1H-pyrrolo[3,2-d]pyrimidin-4(5H)-one;3,5-Dihydro-pyrrolo[3,2-d]pyrimidin-4-one 
1357580-90-5 
D0N5BA 
C6H5N3O 
C6H6N4O 
CID446221 
3,5-Dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one 
A1435 
3,5-Dihydropyrrolo[3,2-d] pyrimidin-4-one 
1H-PYRROLO[3,2-D]PYRIMIDIN-4-OL (9CI) 
4H-Pyrrolo[3,2-d]pyrimidin-4-one, 1,5-dihydro- (8CI,9CI) 
89830-72-8 
65996-58-9 
N/A 
1H-PYRROLO[3,2-D]PYRIMIDIN-4-OL 
Literature
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