AG0034AB

6338-41-6 | 5-Hydroxymethyl-2-furancarboxylic acid

AG0034AB

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CAS Number	6338-41-6
Catalog Number	AG0034AB(AGN-PC-0JLSRY)
Chemical Name	5-Hydroxymethyl-2-furancarboxylic acid
IUPAC Name	5-(hydroxymethyl)furan-2-carboxylic acid
InChI	InChI=1S/C6H6O4/c7-3-4-1-2-5(10-4)6(8)9/h1-2,7H,3H2,(H,8,9)
InChI Key	PCSKKIUURRTAEM-UHFFFAOYSA-N
MDL Number	MFCD03274472
Molecular Formula	C6H6O4
Molecular Weight	142.1094
NSC Number	40739
SMILES	C1=C(OC(=C1)CO)C(=O)O
Synonyms	5-hydroxymethyl-2-furoic acid, HMFA compound, 5-Hydroxymethyl-2-furancarboxylic acid, 6338-41-6, Sumiki's acid, 5-(hydroxymethyl)furan-2-carboxylic acid, 5-Hydroxymethyl-2-furoic acid, 5-(Hydroxymethyl)-2-furoic acid, 5-Hydroxymethyl-furan-2-carboxylic acid, 5-hydroxymethylfuran-2-carboxylic acid, 2-Furancarboxylic acid, 5-(hydroxymethyl)-, 2-Furoic acid, 5-(hydroxymethyl)-, 5-hydroxymethylfuroic acid, 5-Hydroxymethyl-2-furoate, 5-hydroxymethylfuranoic acid, CHEBI:89118, PCSKKIUURRTAEM-UHFFFAOYSA-N, BAS 00404252, EC-000.1550, NSC 40739, HMFCA, 5-hydroxymethylfuroate, 5-hydroxymethylfuranoate, AC1L2ZTX, AC1Q5UHN, ACMC-1B8DO, 5-HMFA, 5-Hydroxymethyl-2-furanoate, DSSTox_CID_13098, DSSTox_RID_79050, DSSTox_GSID_33098, Oprea1_060549, Oprea1_518608, SCHEMBL50822, 5-(Hydroxymethyl)furoic acid, 2-Furancarboxylic acid, 5-(hydroxymethyl)- (9CI), 5-(hydroxymethyl)-2-Furoate, CHEMBL468037, DTXSID5033098, 5-Hydroxymethyl-2-furanoic acid, CTK5B8927, 5-Hydroxymethyl-2-furancarboxylate, 5-hydroxymethylfurancarboxylic acid, HMS1681G08, ZINC327584, ALBB-004523, BCP25291, KS-000002DD, NSC40739, 5-Hydroxymethyl-furan-2-carboxylate, Tox21_201082, ANW-49683, BBL015780, CH-796, GEO-03105, MFCD03274472, NSC-40739, STK256640, AKOS000505137, 5-(hydroxymethyl)- 2-Furancarboxylate, CS-W005241, HY-W005241, MCULE-9435482137, RP20724, RTC-060552, VZ30386, 5-hydroxymethyl-2-furan-carboxylic acid, NCGC00091546-01, NCGC00091546-02, NCGC00091546-03, NCGC00260669-01, 65-I, AC-22968, AJ-19265, AK-26213, AS-18462, BR-26213, SC-95631, 2-Furancarboxylic acid,5-(hydroxymethyl)-, CAS-6338-41-6, AB0025966, AB1010030, DB-054467, ST2412042, TC-060552, 2-Furoic acid, 5-(hydroxymethyl)- (8CI), 4CH-013713, AM20100567, BB 0256593, C2279, FT-0636101, ST45017747, W7536, EN300-91706, C20448, S-2903, 338H416, 5-hydroxymethyl-2-furancarboxylic acid, AldrichCPR, I04-0982, J-517613, Z1262691710, InChI=1/C6H6O4/c7-3-4-1-2-5(10-4)6(8)9/h1-2,7H,3H2,(H,8,9, 2-(Hydroxymethyl)furan-5-carboxylic acid; 5-(Hydroxymethyl)-2-furancarboxylic acid; Sumikis'acid, RARECHEM AL BD 0265 5-HYDROXYMETHYL-2-FURANCARBOXYLIC ACID 5-HYDROXYMETHYL-FURAN-2-CARBOXYLIC ACID Sumiki&#39, (3-chlorobenzyl)hydrazine, 5-Hydroxymethyl-furoic acid, C6H6O4, 2-Furoic acid,5-(hydroxymethyl)-, C6-H6-O4, CID80642, AR-1G8542, 5-HYDROXYMETHYL-FURAN-2-CARBOXYLICACID, 6404-76-8,

Complexity	134
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	142.027g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	142.11g/mol
Monoisotopic Mass	142.027g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	70.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number