AG0034AC

67-47-0 | 5-HYDROXYMETHYLFURFURAL

AG0034AC

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CAS Number	67-47-0
Catalog Number	AG0034AC(AGN-PC-07Y4N4)
Chemical Name	5-HYDROXYMETHYLFURFURAL
EC Number	200-654-9
IUPAC Name	5-(hydroxymethyl)furan-2-carbaldehyde
InChI	InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2
InChI Key	NOEGNKMFWQHSLB-UHFFFAOYSA-N
MDL Number	MFCD00003234
Molecular Formula	C6H6O3
Molecular Weight	126.1100
NSC Number	40738
SMILES	OCC1=CC=C(C=O)O1
UNII	70ETD81LF0
Synonyms	5-(hydroxymethyl)furfural, 5-HM-2-F cpd, 5-HMF cpd, 5-hydroxymethyl furfural, 5-hydroxymethyl-2-furaldehyde, 5-hydroxymethyl-2-furfural, 5-hydroxymethylfuraldehyde, 5-hydroxymethylfurfural, 5-hydroxymethylfurfuraldehyde, Aes-103, hydroxymethylfurfural, 5-HYDROXYMETHYLFURFURAL, 67-47-0, 5-(hydroxymethyl)furan-2-carbaldehyde, 5-(Hydroxymethyl)furfural, 5-Hydroxymethyl-2-furaldehyde, 5-(Hydroxymethyl)-2-furaldehyde, Hydroxymethylfurfural, 5-(Hydroxymethyl)-2-furfural, 5-Oxymethylfurfurole, 5-Hydroxymethylfuraldehyde, Hydroxymethylfurfurole, 5-Hydroxymethylfuran-2-aldehyde, Hydroxymethylfurfuraldehyde, Hydroxymethylfurfuralaldehyde, 2-Hydroxymethyl-5-furfural, 5-Hydroxymethyl-2-formylfuran, 5-(Hydroxymethyl)-2-furancarbonal, 5-(Hydroxymethyl)-2-furfuraldehyde, 2-Furancarboxaldehyde, 5-(hydroxymethyl)-, 5-Hydroxymethylfurfuraldehyde, 5-hydroxymethyl furfural, 5-HYDROXYMETHYL-FURFURAL, 5-(Hyddroxymethyl)furfurole, 5-Hydroxymethyl-2-furfural, 5-(Hydroxymethyl)-2-furancarboxaldehyde, 5-Hydroxymethyl-2-furancarboxaldehyde, HMF, 2-Furaldehyde, 5-(hydroxymethyl)-, 5-(Hydroxymethyl)furan-2-aldehyde, 5-Hydroxymethyl-2-furancarbaldehyde, 5-HMF, UNII-70ETD81LF0, MFCD00003234, NSC 40738, CCRIS 3160, CHEBI:412516, EINECS 200-654-9, 5-(Hydroxymethyl)furfurole, BRN 0110889, 70ETD81LF0, 5-(Hydroxymethyl)-2-formylfuran, NOEGNKMFWQHSLB-UHFFFAOYSA-N, 5-Hydroxymethyl-furan-2-carbaldehyde, 5-(Hydroxymethyl)furan-2-carboxaldehyde, DSSTox_CID_10428, DSSTox_RID_78848, DSSTox_GSID_30428, 5-(Hydroxymethyl)furfural, 98%, CAS-67-47-0, Aes 103, 5-Hydroxymethyl-2-furfuraldehyde, HSDB 7982, 5-methylolfurfural, 5-hydromethyl-furfural, 5-Hydrxoymethylfurfural, 5-formylfurfuryl alcohol, AC1L5YKE, 5-hydroxy methyl furfural, ACMC-1BG6F, Epitope ID:136033, 5-Hydroxymethyl furaldehyde, CBiol_000485, SCHEMBL19176, 5-18-01-00130 (Beilstein Handbook Reference), KSC495A5B, MLS002454379, 2-formyl-5-hydroxymethylfuran, AC1Q7C10, CHEMBL185885, QSPL 022, DTXSID3030428, CTK3J5050, ZINC900788, 5-hydroxymethylfuran-2-carbaldehyde, ACN-S003116, CS-D1116, HY-Y0051, NSC40738, Tox21_201892, Tox21_303551, AN-715, ANW-35343, BBL100102, CH-667, GEO-01528, ICCB3_000133, NSC-40738, SBB004259, STL451297, 5-Hydroxymethyl-2-furaldehyde, 99%, 5-(hydroxymethyl)-2-furfural (HMF), AKOS005166879, AC-1262, DB12298, GS-3074, LS-1562, MCULE-9029574240, RP19668, RTR-022657, TRA0042696, 5-(hydroxymethyl)-furan-2-carbaldehyde, NCGC00091513-01, NCGC00091513-02, NCGC00257266-01, NCGC00259441-01, 4CN-0758, 5-(hydroxymethyl)-2-furan-carboxaldehyde, 5-(Hydroxymethyl)furfural, >=99%, FG, AJ-24320, AK-26249, BC219476, BR-26249, CJ-04519, L782, SC-22154, SMR000393981, ST056380, SY010869, ZB015231, 5-(hydroxy methyl) 2-furan-carboxaldehyde, AB0007209, DB-007058, ST2411674, TR-022657, A9037, AM20100616, FT-0080682, FT-0600483, N1335, EN300-82764, MFCD00003234 (98%), 5-(Hydroxymethyl)furfural, analytical standard, 67H470, C11101, I14-0203, Q-200545, I14-22137, F2191-0155, Z1741972784, InChI=1/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H, HMF (ambiguous), 5-HMF cpd, 5-hydroxy-L-tryptophan, 5-HM-2-F cpd, Aes-103, C6H6O3, C6-H6-O3, CID237332, RW1471, 5-(Hydroxymethyl)furan-2-carbaldehyd, 5-(hydroxymethyl)-furan-2-carbaldehyd, ACN-035254, 5-(Hydroxymethyl)furfural, 98% - 1G 1g, H0269, S-1574, C008046, 1017356-25-0,

Complexity	103
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	126.032g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	126.111g/mol
Monoisotopic Mass	126.032g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	50.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number