1,3-Benzenedimethanol - CAS 626-18-6

Catalog:	BB031691
Product Name:	1,3-Benzenedimethanol
CAS:	626-18-6
Synonyms:	[3-(hydroxymethyl)phenyl]methanol

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	[3-(hydroxymethyl)phenyl]methanol
Description:	1,3-Benzenedimethanol (CAS# 626-18-6) is a useful research chemical.
Molecular Weight:	138.16
Molecular Formula:	C8H10O2
Canonical SMILES:	C1=CC(=CC(=C1)CO)CO
InChI:	InChI=1S/C8H10O2/c9-5-7-2-1-3-8(4-7)6-10/h1-4,9-10H,5-6H2
InChI Key:	YWMLORGQOFONNT-UHFFFAOYSA-N
Boiling Point:	154-159 °C (13 mmHg)
Melting Point:	56-60 °C
Purity:	95 %
Density:	1.18 g/cm³
Appearance:	White crystalline powder and chunks
MDL:	MFCD00004649
LogP:	0.67120

Publication Number	Title	Priority Date
CN-113480964-A	High-temperature-resistant hydrolysis-resistant polyurethane hot melt adhesive and preparation method thereof	20210622
CN-113480967-A	High-temperature-resistant polyurethane hot melt adhesive and preparation method thereof	20210622
CN-112979937-A	Polycarbonate and synthetic method thereof, rigid monomer and preparation method thereof	20210426
CN-112979937-B	Polycarbonate and synthetic method thereof, rigid monomer and preparation method thereof	20210426
KR-102305712-B1	Heat reflection waterproof film with excellent tensile strength and thermal barrier performance, its manufacturing method and its construction method	20210122

PMID	Publication Date	Title	Journal
19200743	20090301	Synthesis of nuclease-resistant siRNAs possessing universal overhangs	Bioorganic & medicinal chemistry
18783944	20081001	Synthesis of nuclease-resistant siRNAs possessing benzene-phosphate backbones in their 3'-overhang regions	Bioorganic & medicinal chemistry letters
21202084	20080312	Bis(4-nitro-phen-yl) 1,3-phenyl-ene-dimethyl-ene dicarbonate	Acta crystallographica. Section E, Structure reports online
12444608	20021129	Synthesis and characterization of mono- and bis-methano[60]fullerenyl amino acid derivatives and their reductive ring-opening retro-bingel reactions	The Journal of organic chemistry

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Related Functional Groups

Alcohols and Derivatives

[58287-18-6]
(1R)-1-(4-Nitrophenyl)ethanol
[1251261-18-3]
3-Amino-2-(cyclohexylmethyl)-1-propanol
[2058331-75-0]
3-Bromo-1,1-difluoro-2-propanol
[3736-77-4]
2,2'-Anhydrouridine
[67107-87-3]
12-Amino-1-dodecanol
[16764-24-2]
2,6-Di-tert-butyl-4-pent-4-enyl-phenol

Oxygen Compounds

[77987-49-6]
Z-Glycinol
[52378-69-5]
Diethyl trans-cinnamylphosphonate
[1281984-38-0]
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[202288-73-1]
2-(Pyridin-3-ylmethoxy)aniline dihydrochloride

GHS Hazard Statement:	H302 (97.56%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501
Signal Word:	Warning

Complexity:	83.3
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	138.068079557
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	138.068079557
Rotatable Bond Count:	2
Topological Polar Surface Area:	40.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2