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Propylphosphonic Acid

CAT: 0572-TRC-P835080-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-P835080-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
4672-38-2
Synonyms
Phosphonic acid, P-propyl-; Phosphonic acid, propyl- (6CI,7CI,8CI,9CI); P-Propylphosphonic acid; 1-Propanephosphonic acid; Dihydrogen propylphosphona
Hazard Statement
Causes severe skin burns and eye damage; UN number: UN3260; Packing Group: III
Purity
>95% (HPLC)
Smiles
CCCP(=O)(O)O
Molecular Formula
C3 H9 O3 P
Molecular Weight
124.076
InChI
InChI=1S/C3H9O3P/c1-2-3-7(4,5)6/h2-3H2,1H3,(H2,4,5,6)
Additionnal Information
IUPAC name: propylphosphonic acid
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Propylphosphonic acid
CAS Number4672-38-2
PubChem CID204484
IUPAC Namepropylphosphonic acid
Molecular FormulaC3H9O3P
Molecular Weight124.08
XLogP-0.7
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count7
Formal Charge0
Complexity84
SMILES
CCCP(=O)(O)O
InChI
InChI=1S/C3H9O3P/c1-2-3-7(4,5)6/h2-3H2,1H3,(H2,4,5,6)
InChIKey
NSETWVJZUWGCKE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Propylphosphonic acid
CAS: 4672-38-2
CID: 204484
Formula: C3H9O3P
MW: 124.08
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight124.08
XLogP3-0.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass124.02893114
Monoisotopic Mass124.02893114
Topological Polar Surface Area57.5 Ų
Heavy Atom Count7
Formal Charge0
Complexity84.2
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

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Alternative Products

CatalogName
sc-236493BPropylphosphonic acid
286528-01Propylphosphonic acid anhydride
FE1024393- (Ethyl- (1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Heptadecafluorooctylsulfonyl) Amino) Propylphosphonic Acid
sc-253322Propylphosphonic anhydride solution
463118-01Propylphosphonic Anhydride (50% wt. in Ethyl Acetate)
OR1071368-01Acid-apeg6-acid
MBS6083807-01Medronic Acid (Methylenebiphosphonic Acid, Methylenediphosphonic Acid, Methanebisphosphonic Acid, Methanediphosphonic Acid, MDP)
L2500-01Lipoic Acid (Thioctic Acid, (±) -α-Lipoic Acid)
041005Cacodylic Acid (dimethylarsonic acid, dimethylarsinic acid)
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