Basic information
- CAS
718599-64-5- Standard SMILES
O=C(NO)[C@H](O)[C@H](O)COP(=O)(O)O- InChIKey
JJQQOJRGUHNREK-PWNYCUMCSA-N- Molecular formula
- C4H10NO8P
- Average molar mass
- 231.1 g/mol
- Monoisotopic mass
- 231.01440327
Names & identifiers
- Preferred name
- 4-Phospho-D-erythronohydroxamic acid
- IUPAC
- [(2R,3R)-2,3-dihydroxy-4-(hydroxyamino)-4-oxobutyl] dihydrogen phosphate
- English name
- Butanamide, N,2,3-trihydroxy-4-(phosphonooxy)-, (2R,3R)-
- Molecular formula
- C4H10NO8P
- Molecular weight
- 231.1
Names & synonyms
718599-64-54-PHOSPHO-D-ERYTHRONOHYDROXAMIC ACIDRefChem:526464((2R,3R)-2,3-dihydroxy-3-(hydroxycarbamoyl)propoxy)phosphonic acid(2R,3R)-2,3-Dihydroxy-4-(hydroxyamino)-4-oxobutyl dihydrogen phosphateCHEMBL116018[(2R,3R)-2,3-dihydroxy-4-(hydroxyamino)-4-oxobutyl] dihydrogen phosphaterel-(2R,3R)-2,3-Dihydroxy-4-(hydroxyamino)-4-oxobutyl dihydrogen phosphate1310908-09-8RES2besDB04496
Show more names
Butanamide, N,2,3-trihydroxy-4-(phosphonooxy)-, (2R,3R)-(2R,3R)-2,3-Dihydroxy-4-(hydroxyamino)-4-oxobutyl?dihydrogen?phosphate
C4H10NO8PSCHEMBL2219243DTXSID10332304BDBM50148767MFCD27927871PD059244NS00070032(2R,3R)-2,3-Dihydroxy-4-(hydroxyamino)-4-oxobutyldihydrogenphosphate
Database identifiers
- CAS
718599-64-5- PubChem CID
- 449303
- DTXSID
DTXSID10332304
Properties
Computed structural properties
- XLogP
- -4
- Topological polar surface area
- 157 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 237
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Density
- 1.937 · 1.937±0.06 g/cm3(Predicted)
- pka
- 1.82 · 1.82±0.10(Predicted)
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H315-H318-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- Hazard statements
- H302-H315-H318-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers6 total
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
广州凯途化学有限公司18933936954 · [email protected]
上海景容化学科技有限公司021-60546673 13701861782 · [email protected]
张家界恒康生物药业有限公司13975184000 · [email protected]
ANHUI WITOP BIOTECH CO., LTD+8618071025641 · [email protected]
Guangzhou CATO Research Chemicals Inc.+86-020-81960175-617 18520203721 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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