2'-Hydroxypropiophenone

CAT: 0926-FH71327-01Size: 2 KgDry Ice: NoHazardous: No

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CAT#:0926-FH71327-01Size:2 Kg

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CAS Number

610-99-1

Synonyms

2- (Propionyl) phenol

Smiles

CCC (=O) C1=CC=CC=C1O

Molecular Formula

C9H10O2

Molecular Weight

150.17 g/mol

Controlled

Chemical Information

2'-Hydroxypropiophenone

2'-hydroxypropiophenone is an aromatic ketone.

CAS Number	610-99-1
PubChem CID	69133
IUPAC Name	1-(2-hydroxyphenyl)propan-1-one
Molecular Formula	C9H10O2
Molecular Weight	150.17
XLogP	2.5
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	142

SMILES

CCC(=O)C1=CC=CC=C1O

InChI

InChI=1S/C9H10O2/c1-2-8(10)7-5-3-4-6-9(7)11/h3-6,11H,2H2,1H3

InChIKey

KDUWXMIHHIVXER-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 610-99-1

CID: 69133

Formula: C9H10O2

MW: 150.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	150.17
XLogP3	2.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	150.068079557
Monoisotopic Mass	150.068079557
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	142
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FH71324-01	4-Hydroxypropiophenone
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WYB72229-01	2,2,2-Trifluoroethyl N- (2,2,2-trifluoroethyl) carbamate
IXB41367-01	(2,2-Dimethylpropyl) (2,2,2-trifluoroethyl) amine
FB15824-01	2,2-Bis (hydroxymethyl) -2,2',2''-nitrilotriethanol
IGA88442-01	2- (2,2,2-Trifluoroethyl) benzaldehyde
AAC81537-01	2- (2,2,2-Trifluoroethoxy) propanenitrile
KJD25151-01	2-Ethynylbicyclo[2.2.2]octane
HCA63104-01	2- (2,2,2-Trifluoroethyl) aniline
FT78199-01	2,2,2-Trifluoroethanethiol

Catalog	Name
T29353	2-Hydroxypropiophenone
BUP16982-01	2'-Hydroxypropiophenone
OR1010234-01	2’-Hydroxypropiophenone
TRC-H952515-500G	p-Hydroxypropiophenone
sc-227026	5'-Bromo-2'-hydroxypropiophenone
PC9810-01	5'-Fluoro-2'-hydroxypropiophenone
PC501294	2'-Fluoro-6'-hydroxypropiophenone
OR22407-01	4'-Amino-2'-hydroxypropiophenone
OR22404-01	5'-Chloro-2'-hydroxypropiophenone
S5396-25mg	4'-Hydroxypropiophenone