2,6-Bis(hydroxymethyl)-p-cresol

Modify Date: 2024-01-03 11:28:57

2,6-Bis(hydroxymethyl)-p-cresol Structure
2,6-Bis(hydroxymethyl)-p-cresol structure
 Common Name 2,6-Bis(hydroxymethyl)-p-cresol
CAS Number 91-04-3 Molecular Weight 168.190
Density 1.3±0.1 g/cm3 Boiling Point 333.3±11.0 °C at 760 mmHg
Molecular Formula C9H12O3 Melting Point 128-130 °C(lit.)
MSDS Chinese USA Flash Point 166.1±13.9 °C
Symbol GHS07
GHS07		 Signal Word Warning

 Names

Name 2,6-Bis(hydroxymethyl)-p-cresol
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 333.3±11.0 °C at 760 mmHg
Melting Point 128-130 °C(lit.)
Molecular Formula C9H12O3
Molecular Weight 168.190
Flash Point 166.1±13.9 °C
Exact Mass 168.078644
PSA 60.69000
LogP -0.43
Vapour density 5.8 (vs air)
Vapour Pressure 0.0±0.8 mmHg at 25°C
Index of Refraction 1.613

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CZ6440000
CHEMICAL NAME :
1,3-Benzenedimethanol, 2-hydroxy-5-methyl-
CAS REGISTRY NUMBER :
91-04-3
BEILSTEIN REFERENCE NO. :
1240237
LAST UPDATED :
199701
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C9-H12-O3
MOLECULAR WEIGHT :
168.21

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Parenteral
SPECIES OBSERVED :
Amphibian - frog
DOSE/DURATION :
1250 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - miosis (pupillary constriction) Behavioral - altered sleep time (including change in righting reflex) Lungs, Thorax, or Respiration - respiratory depression
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 26,123,1926

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xi:Irritant;
Risk Phrases R36/37/38
Safety Phrases S26-S37/39
RIDADR NONH for all modes of transport
WGK Germany 3
RTECS CZ6440000

 Synthetic Route

Formaldehyde structure

Formaldehyde

CAS#:50-00-0
p-Cresol structure

p-Cresol

CAS#:106-44-5

~94%

2,6-Bis(hydroxymethyl)-p-cresol Structure

2,6-Bis(hydroxy...

CAS#:91-04-3
Literature: Gupta, Rajeev; Mukherjee, Sumitra; Mukherjee, Rabindranath Journal of the Chemical Society - Dalton Transactions, 1999 , # 22 p. 4025 - 4030
Formaldehyde structure

Formaldehyde

CAS#:50-00-0
o-cresol structure

o-cresol

CAS#:95-48-7

~%

2,6-Bis(hydroxymethyl)-p-cresol Structure

2,6-Bis(hydroxy...

CAS#:91-04-3
Literature: US4769501 A1, ;
Formaldehyde structure

Formaldehyde

CAS#:50-00-0
p-Cresol structure

p-Cresol

CAS#:106-44-5

~22%

2,6-Bis(hydroxymethyl)-p-cresol Structure

2,6-Bis(hydroxy...

CAS#:91-04-3

2,2'-Methylenebis[4-methyl-6-(hydroxymethyl)phenol] structure

2,2'-Methyleneb...

CAS#:22247-58-1
Literature: Tetrahedron, , vol. 54, # 40 p. 12185 - 12196
p-Cresol structure

p-Cresol

CAS#:106-44-5

~%

2,6-Bis(hydroxymethyl)-p-cresol Structure

2,6-Bis(hydroxy...

CAS#:91-04-3
Literature: Ricerca Scientifica, , vol. 24, p. 62,65
Formaldehyde structure

Formaldehyde

CAS#:50-00-0
p-Cresol structure

p-Cresol

CAS#:106-44-5

~%

2,6-Bis(hydroxymethyl)-p-cresol Structure

2,6-Bis(hydroxy...

CAS#:91-04-3

Benzenemethanol,2-hydroxy-5-methyl- structure

Benzenemethanol...

CAS#:4383-07-7
Literature: Chemische Berichte, , vol. 40, p. 2528
2-hydroxy-5-methyl-3-thiocyanatomethyl-benzyl alcohol structure

2-hydroxy-5-met...

CAS#:409317-20-0
Acetone structure

Acetone

CAS#:67-64-1

~%

2,6-Bis(hydroxymethyl)-p-cresol Structure

2,6-Bis(hydroxy...

CAS#:91-04-3
Literature: Monatshefte fuer Chemie, , vol. 79, p. 316,319
2-Hydroxy-5-methyl-1.3-bis-thiocyanatomethyl-benzol structure

2-Hydroxy-5-met...

CAS#:126742-55-0
Acetone structure

Acetone

CAS#:67-64-1

~%

2,6-Bis(hydroxymethyl)-p-cresol Structure

2,6-Bis(hydroxy...

CAS#:91-04-3
Literature: Monatshefte fuer Chemie, , vol. 79, p. 316,319

 Articles1

More Articles
Single crystal-to-single crystal irreversible transformation from a discrete vanadium(V)-alcoholate to an aldehydic-vanadium(IV) oligomer.

J. Am. Chem. Soc. 132(45) , 15842-5, (2010)

An unprecedented single crystal-to-single crystal transformation occurs when a binuclear oxovanadium(V) compound [V(V)(2)O(2)(L)(2)] 1 involving 2,6-bis(hydroxymethyl)-p-cresol (H(3)L) as a bridging l...

 Synonyms

2,6-di(hydroxymethyl)-4-methylphenol
EINECS 202-036-4
MFCD00004619
2,6-Bis(hydroxymethyl)-4-methylphenol
2,6-Bis(hydroxymethyl)-p-cresol
1,3-Benzenedimethanol, 2-hydroxy-5-methyl-
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