Phloroglucinol dihydrate

CAT: 0926-FP12342Size: 0.5 KgDry Ice: NoHazardous: No

1 / 1

CAT#:0926-FP12342Size:0.5 Kg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

6099-90-7

MDL Number

MFCD00149090

Smiles

C1=C (C=C (C=C1O) O) O.O.O

Molecular Formula

C6H6O3• (H2O) 2

Molecular Weight

162.14 g/mol

Controlled

Chemical Information

1,3,5-Benzenetriol, hydrate (1:2)

CAS Number	6099-90-7
PubChem CID	53233771
IUPAC Name	benzene-1,3,5-triol;hydrate
Molecular Formula	C6H8O4
Molecular Weight	144.12
Topological Polar Surface Area	61.7
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	63

SMILES

C1=C(C=C(C=C1O)O)O.O

InChI

InChI=1S/C6H6O3.H2O/c7-4-1-5(8)3-6(9)2-4;/h1-3,7-9H;1H2

InChIKey

JPLWLTSPJLPUQK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6099-90-7

CID: 53233771

Formula: C6H8O4

MW: 144.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	144.12
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	144.04225873
Monoisotopic Mass	144.04225873
Topological Polar Surface Area	61.7 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	63.3
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	2
Compound Is Canonicalized	Yes

Catalog	Name
FP12341-01	Phloroglucinol
EDC49724-01	Phloroglucinol-13C6
ACA60276-01	Phloroglucinol glucuronide
FP70605-01	Potassium phloroglucinol carboxylate
FP70476-01	Phloroglucinol aldehyde triethyl ether
FP78801-01	Pyrogallol-Phloroglucinol-6,6-Bieckol
SEA77270-01	Azithromycin Dihydrate
SEA60950	Tauroursodeoxycholate dihydrate
FC32773-01	Cidofovir dihydrate
FM173346	Morin dihydrate

Catalog	Name
TRC-P340005-25G	Phloroglucinol Dihydrate
241243-01	Phloroglucinol Dihydrate 99+%
462488-01	Phloroglucinol dihydrate 241243. See 241243 discontinued
41600080-1	Phloroglucinol