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1,2-Ethanediol, 1-(dihydrogen phosphate), compd. with urea (1:2)

HCID 110327
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Basic information

CAS
68444-18-8
Standard SMILES
NC(N)=O.NC(N)=O.O=P(O)(O)OCCO
InChIKey
QUHOKSIUZIAPQY-UHFFFAOYSA-N
Molecular formula
C4H15N4O7P
Average molar mass
262.16 g/mol
Monoisotopic mass
262.06783583

Names & identifiers

Preferred name
1,2-Ethanediol, 1-(dihydrogen phosphate), compd. with urea (1:2)
IUPAC
2-hydroxyethyl dihydrogen phosphate;urea

Names & synonyms

EINECS 270-589-9Ethylene glycol, monophosphated, urea salt (1:2)RefChem:41202168444-18-8DTXSID60988097Hydroxyethyl dihydrogen phosphate, compound with urea (1:2)Carbamimidic acid--2-hydroxyethyl dihydrogen phosphate (2/1)

Database identifiers

CAS
68444-18-8
PubChem CID
110327
DTXSID
DTXSID60988097
EC Number
270-589-9

Properties

Computed structural properties

Topological polar surface area
225 Ų
Hydrogen bond donors
7
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
16
Formal charge
0
Complexity
124

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1,2-Ethanediol, 1-(dihydrogen phosphate), compd. with urea (1:2): INACTIVE

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Compound notes

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