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Monoisopropyl Phosphate

CAT: 1596-AR-P31474-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-P31474-01Size:10 Units
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CAS Number
1623-24-1
Synonyms
Isopropyl dihydrogen phosphate
Molecular Formula
C3H9O4P
Molecular Weight
140.07
API Name
Phosphonic acid

Chemical Information

Monoisopropyl phosphate

Isopropyl dihydrogen phosphate is monophosphorylated isopropyl alcohol. It has a role as a phosphoantigen.

CAS Number1623-24-1
PubChem CID15391
IUPAC Namepropan-2-yl dihydrogen phosphate
Molecular FormulaC3H9O4P
Molecular Weight140.07
XLogP-0.8
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count8
Formal Charge0
Complexity104
SMILES
CC(C)OP(=O)(O)O
InChI
InChI=1S/C3H9O4P/c1-3(2)7-8(4,5)6/h3H,1-2H3,(H2,4,5,6)
InChIKey
QPPQHRDVPBTVEV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Monoisopropyl phosphate
CAS: 1623-24-1
CID: 15391
Formula: C3H9O4P
MW: 140.07
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight140.07
XLogP3-0.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass140.02384576
Monoisotopic Mass140.02384576
Topological Polar Surface Area66.8 Ų
Heavy Atom Count8
Formal Charge0
Complexity104
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes