Propyl 2-bromo-4-hydroxybenzoate

CAT: 0127-OR1061775-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1061775-01Size:100 mg

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CAS Number

2803476-78-8

Purity

98%

Smiles

O=C(OCCC)C1=CC=C(O)C=C1Br

Chemical Information

Propyl 2-bromo-4-hydroxybenzoate

CAS Number	2803476-78-8
PubChem CID	162624170
IUPAC Name	propyl 2-bromo-4-hydroxybenzoate
Molecular Formula	C10H11BrO3
Molecular Weight	259.10
XLogP	3.9
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	14
Formal Charge	0
Complexity	196

SMILES

CCCOC(=O)C1=C(C=C(C=C1)O)Br

InChI

InChI=1S/C10H11BrO3/c1-2-5-14-10(13)8-4-3-7(12)6-9(8)11/h3-4,6,12H,2,5H2,1H3

InChIKey

HAPBFZPNEPVINM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2803476-78-8

CID: 162624170

Formula: C10H11BrO3

MW: 259.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	259.10
XLogP3	3.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	257.98916
Monoisotopic Mass	257.98916
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	196
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
OR1061656-01	Propyl 3-bromo-4-hydroxybenzoate
OR923454-01	Propyl 4-hydroxybenzoate
OR400066-01	Methyl 4-bromo-2-hydroxybenzoate
OR1064308-01	Ethyl 4-bromo-2-hydroxybenzoate
OR400687-01	Methyl 2-bromo-4-hydroxybenzoate
OR957605	Propyl-3-hydroxybenzoate
OR77459-01	Tert-Butyl 4-bromo-2-hydroxybenzoate
OR1031922-01	3- (Dibutylamino) propyl 4-hydroxybenzoate (Hydrochloride)
OR1079934	Propyl 3,5-dichloro-4-hydroxybenzoate
OR40406-01	Methyl 4-amino-5-bromo-2-hydroxybenzoate

Catalog	Name
RG-A262174-01	Propyl 3-Bromo-4-Hydroxybenzoate
GK2194-500g	Propyl 4-hydroxybenzoate
AR-C04094-01	Propyl 4-Hydroxybenzoate (Propyl Paraben)
TRC-P838285-10G	Propyl 4-Hydroxybenzoate(Propyl Paraben)
FP63482-01	N-Propyl-4-hydroxybenzoate
286408-01	Propyl Paraben (4-Hydroxybenzoate)
GX7720-250g	Propyl 4-hydroxybenzoate sodium salt
1161850 25	Propyl-4-Hydroxybenzoate Extra Pure
P27552-01	Propyl p-hydroxybenzoate
TRC-P839408-10MG	Propyl 3,5-Dichloro-4-hydroxybenzoate