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3- (Methylphosphinico) propionic acid

CAT: 0926-FM172706-02Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0926-FM172706-02Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
15090-23-0
Smiles
CP (O) (=O) CCC (O) =O
Molecular Formula
C4H9O4P
Molecular Weight
152.09 g/mol
Controlled
No

Chemical Information

3-(Hydroxymethylphosphinyl)propionic acid

structure in first source

CAS Number15090-23-0
PubChem CID84788
IUPAC Name3-[hydroxy(methyl)phosphoryl]propanoic acid
Molecular FormulaC4H9O4P
Molecular Weight152.09
XLogP-1.6
Topological Polar Surface Area74.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count9
Formal Charge0
Complexity153
SMILES
CP(=O)(CCC(=O)O)O
InChI
InChI=1S/C4H9O4P/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)(H,7,8)
InChIKey
QXFUBAAEKCHBQY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(Hydroxymethylphosphinyl)propionic acid
CAS: 15090-23-0
CID: 84788
Formula: C4H9O4P
MW: 152.09
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight152.09
XLogP3-1.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass152.02384576
Monoisotopic Mass152.02384576
Topological Polar Surface Area74.6 Ų
Heavy Atom Count9
Formal Charge0
Complexity153
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