2-Methylresorcinol pure, 98%

CAT: 0565-33878-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0565-33878-01Size:25 g

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Description

Part B

CAS Number

608-25-3

UN Code

UN No.: 2811, IMCO Class No.: 6.1, Packing Group: III

Storage Temperature

2 - 8°C

Chemical Information

2-Methylresorcinol

CAS Number	608-25-3
PubChem CID	11843
IUPAC Name	2-methylbenzene-1,3-diol
Molecular Formula	C7H8O2
Molecular Weight	124.14
XLogP	1.6
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	9
Formal Charge	0
Complexity	82

SMILES

CC1=C(C=CC=C1O)O

InChI

InChI=1S/C7H8O2/c1-5-6(8)3-2-4-7(5)9/h2-4,8-9H,1H3

InChIKey

ZTMADXFOCUXMJE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 608-25-3

CID: 11843

Formula: C7H8O2

MW: 124.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	124.14
XLogP3	1.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	124.052429494
Monoisotopic Mass	124.052429494
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	82.9
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

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