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N-Propylboronic Acid

CAT: 0572-TRC-P835060-2.5GSize: 2.5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-P835060-2.5GSize:2.5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
17745-45-8
Synonyms
1-Propylboronic Acid; Dihydroxy(propyl)boron; Dihydroxypropylborane; NSC 518339
Hazard Statement
No Data Available
Smiles
OB(CCC)O
Molecular Formula
C3H9BO2
Molecular Weight
87.91
InChI
InChI=1S/C3H9BO2/c1-2-3-4(5)6/h5-6H,2-3H2,1H3
Additionnal Information
IUPAC name: propylboronic acid
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

1-Propylboronic acid
CAS Number17745-45-8
PubChem CID351065
IUPAC Namepropylboronic acid
Molecular FormulaC3H9BO2
Molecular Weight87.92
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count6
Formal Charge0
Complexity30
SMILES
B(CCC)(O)O
InChI
InChI=1S/C3H9BO2/c1-2-3-4(5)6/h5-6H,2-3H2,1H3
InChIKey
JAQOMSTTXPGKTN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Propylboronic acid
CAS: 17745-45-8
CID: 351065
Formula: C3H9BO2
MW: 87.92
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight87.92
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass88.0695597
Monoisotopic Mass88.0695597
Topological Polar Surface Area40.5 Ų
Heavy Atom Count6
Formal Charge0
Complexity30
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
459623-01N-Propylboronic Acid
HY-W007470-01Propylboronic acid
sc-2248171-Propylboronic acid catechol ester
425199-013-Cyano-1-propylboronic acid pinacol ester
422491-013- (2-Hydroxyphenyl) propylboronic Acid Pinacol Ester
sc-299113A3-Trimethylsilyl-1-propylboronic acid pinacol ester
sc-2658882-Phenyl-1-propylboronic acid pinacol ester
sc-2668233-Phenyl-1-propylboronic acid pinacol ester
OR3613913- (4-Methoxyphenyl) propylboronic acid, pinacol ester
422895-013- (4-Fluorophenyl) propylboronic acid pinacol ester

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