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1190-24-5 molecular structure
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formylurea

ChemBase ID: 109953
Molecular Formular: C2H4N2O2
Molecular Mass: 88.06536
Monoisotopic Mass: 88.02727738
SMILES and InChIs

SMILES:
NC(=O)NC=O
Canonical SMILES:
O=CNC(=O)N
InChI:
InChI=1S/C2H4N2O2/c3-2(6)4-1-5/h1H,(H3,3,4,5,6)
InChIKey:
JOWMUPQBELRFRZ-UHFFFAOYSA-N

Cite this record

CBID:109953 http://www.chembase.cn/molecule-109953.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
formylurea
IUPAC Traditional name
formylurea
Synonyms
N-Formylurea
FORMYLUREA
N-甲酰基脲
CAS Number
1190-24-5
EC Number
214-719-4
MDL Number
MFCD00039769
Beilstein Number
1745350
PubChem SID
162095692
PubChem CID
70922

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 70922 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 11.966354  H Acceptors
H Donor LogD (pH = 5.5) -1.4239244 
LogD (pH = 7.4) -1.4239359  Log P -1.4239242 
Molar Refractivity 18.218 cm3 Polarizability 7.018457 Å3
Polar Surface Area 72.19 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
168-170°C expand Show data source
MSDS Link
Download expand Show data source
TSCA Listed
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Purity
98% expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05213164 external link
MP Biomedicals Rare Chemical collection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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