Cis-Propenylphosphonic acid

CAT: 1596-AR-P01838-01Size: 250 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-P01838-01Size:250 Units

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CAS Number

25383-06-6

Synonyms

(Z) -prop-1-en-1-ylphosphonic acid

Molecular Formula

C3H7O3P

Molecular Weight

122.06

API Name

Phosphonic Acid

Chemical Information

P-(1Z)-1-Propen-1-ylphosphonic acid

RN given is for (Z) isomer; structure given in first source

CAS Number	25383-06-6
PubChem CID	6436667
IUPAC Name	[(Z)-prop-1-enyl]phosphonic acid
Molecular Formula	C3H7O3P
Molecular Weight	122.06
XLogP	-0.9
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	7
Formal Charge	0
Complexity	111

SMILES

C/C=C\P(=O)(O)O

InChI

InChI=1S/C3H7O3P/c1-2-3-7(4,5)6/h2-3H,1H3,(H2,4,5,6)/b3-2-

InChIKey

XWCIXXXLOAAWPU-IHWYPQMZSA-N

Chemical Structure

2D Structure

CAS: 25383-06-6

CID: 6436667

Formula: C3H7O3P

MW: 122.06

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	122.06
XLogP3	-0.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	122.01328108
Monoisotopic Mass	122.01328108
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	111
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FP156974-01	Cis-Propenylphosphonic acid
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TRC-P768980-500MG	cis-Propenylphosphonic Acid (R)-(+)-Alpha-Methylbenzylamine Salt
RM-P182502-01	1-Propenylphosphonic Acid
OR1012666-01	Cis Cis-Muconic Acid
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