Cas no 176773-01-6 (4-Pyrimidinol,2,3-dihydro-2-imino-, (E)- (9CI))
176773-01-6 structure
Product Name:4-Pyrimidinol,2,3-dihydro-2-imino-, (E)- (9CI)
CAS No:176773-01-6
MF:C4H5N3O
MW:111.101999998093
CID:112456
PubChem ID:66950
Update Time:2025-04-18
4-Pyrimidinol,2,3-dihydro-2-imino-, (E)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 4-Pyrimidinol,2,3-dihydro-2-imino-, (E)- (9CI)
- 4-Pyrimidinol, 2,3-dihydro-2-imino-, (E)- (9CI)
- 145358-63-0
- 155831-92-8
- 2-Amino-4-hydroxypyrimidine
- 2-Imino-6-pyrimidinon
- 4-Pyrimidinol, 2-amino- (9CI)
- AI3-52238
- SB57721
- InChI=1/C4H5N3O/c5-4-6-2-1-3(8)7-4/h1-2H,(H3,5,6,7,8
- 4-Pyrimidinol, 2,3-dihydro-2-imino- (9CI)
- CS-W002272
- DTXSID00148350
- 107646-85-5
- 4(3H)-Pyrimidinone, 2-amino-
- 4(1H)-Pyrimidinone, 2,3-dihydro-2-imino-, (E)- (9CI)
- CHEBI:55502
- 4(1H)-Pyrimidinone, 2-amino-
- Isocytosine (VAN)
- W-200787
- 176773-00-5
- SB10360
- MFCD00057557
- 2-AMINO-3,4-DIHYDROPYRIMIDIN-4-ONE
- 674-97-5
- 2-Amino-4(1H)-pyrimidinone
- 2-aminopyrimidin-4-ol
- 4-Pyrimidinol, 1,2-dihydro-2-imino- (9CI)
- 4(1H)-Pyrimidinone, 2,3-dihydro-2-imino-, (Z)- (9CI)
- SCHEMBL8852643
- 4-Pyrimidinol, 2,3-dihydro-2-imino-, (Z)- (9CI)
- DS-0256
- 4(1H)-Pyrimidinone,2,3-dihydro-2-imino-,(E)-(9ci)
- AM20080033
- Epitope ID:119698
- NS00015768
- EN300-64686
- Q10859790
- 2-Amino-4-pyrimdinol
- NSC49118
- AC-907/25004299
- AKOS016034248
- 107646-87-7
- SCHEMBL4825
- 4-pyrimidinol,2-amino-
- AKOS010519665
- CS-0166939
- 4-Pyrimidinol, 1,2-dihydro-2-imino-, (Z)- (9CI)
- SY013450
- 2-Amino-3H-pyrimidin-4-one
- PB29007
- 176773-02-7
- 2-amino-1H-pyrimidin-4-one
- 2-aminopyrimidin-4(3H)-one
- 2-Amino-4-hydroxypyrimidine, 2-Aminouracil
- Isocytosine
- 1,4-dihydro-2-amino-4-oxopyrimidine
- I0814
- Iso Cytosine
- FT-0693428
- HY-W002272
- s6256
- MFCD00023256
- 155831-94-0
- H10127
- isocytosin
- 2-Amino-4(1H)-pyrimidinone #
- 4-Pyrimidinol, 2-amino-
- 2-Amino-4-pyrimidol
- CHEMBL56260
- 2-amino-4-pyrimidinol
- 176773-01-6
- BDBM50405230
- 2-Aminouracil
- AKOS015854926
- 155831-93-9
- 100643-25-2
- 2-amino-6-hydroxypyrimidine
- EINECS 203-592-0
- 2-aminopyrimidin-4(1H)-one
- Z801295650
- 2-Amino-4-oxypyrimidine
- Isocytosine, >=99%
- 2-Amino-4-pyrimidone
- 4(1H)-Pyrimidinone, 2,3-dihydro-2-imino- (9CI)
- NSC-49118
- FT-0602441
- 2-amino-1H-pyrimidin-6-one
- NSC 49118
- 108-53-2
- 2-amino-1,4-dihydropyrimidin-4-one
- 4(1H)-Pyrimidinone, 2-amino-(9CI)
- DB-272064
- DB-272200
- pyrimidine, 2-amino-4-hydroxy-
- 203-592-0
- DB-272859
- DB-272045
- 4-PYRIMIDINOL, 2,3-DIHYDRO-2-IMINO-
- DB-272856
- DB-016150
- 176772-97-7
- DB-346942
- 4(1H)-PYRIMIDINONE, 2,3-DIHYDRO-2-IMINO-
- 4-PYRIMIDINOL, 1,2-DIHYDRO-2-IMINO-
- FI07235
- DTXCID2070841
-
- Inchi： 1S/C4H5N3O/c5-4-6-2-1-3(8)7-4/h1-2H,(H3,5,6,7,8)
- InChI Key： XQCZBXHVTFVIFE-UHFFFAOYSA-N
- SMILES： O=C1C=CN=C(N)N1
Computed Properties
- Exact Mass: 111.04335
- Monoisotopic Mass: 111.043
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 170
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: _1
- Topological Polar Surface Area: 67.5A^2
Experimental Properties
- Color/Form: White to grayish white solid
- Density: 1.55
- Boiling Point: 252.7 oC
- Flash Point: 106.7 oC
- Refractive Index: 1.688
- PSA: 68.47
4-Pyrimidinol,2,3-dihydro-2-imino-, (E)- (9CI) Related Literature
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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