| CAS Number | 478358-10-0 |
| Catalog Number | AG01AA38(AGN-PC-0L8FQ6) |
| Chemical Name | 4-({[(Furan-2-yl)methyl]amino}methyl)phenol |
| IUPAC Name | 4-[(furan-2-ylmethylamino)methyl]phenol |
| InChI | InChI=1S/C12H13NO2/c14-11-5-3-10(4-6-11)8-13-9-12-2-1-7-15-12/h1-7,13-14H,8-9H2 |
| InChI Key | JBPCVNXGKWPNRG-UHFFFAOYSA-N |
| MDL Number | MFCD00479761 |
| Molecular Formula | C12H13NO2 |
| Molecular Weight | 203.2371 |
| SMILES | OC1=CC=C(CNCC2OC=CC=2)C=C1 |
| Synonyms | 4-{[(furan-2-ylmethyl)amino]methyl}phenol,
4-({[(furan-2-yl)methyl]amino}methyl)phenol,
478358-10-0,
AC1N7HQ8,
AC1Q78VF,
SCHEMBL16523593,
CTK7J9354,
ZINC6322484,
N-furfuryl-N-(4-hydroxybenzyl)amine,
STK129128,
AKOS000134136,
MCULE-8870830413,
NE18085,
4-[(furan-2-ylmethylamino)methyl]phenol,
NCGC00337144-01,
EN300-66907,
4-{[(2-FURYLMETHYL)AMINO]METHYL}PHENOL,
AB01331003-02,
Z234897667,
4-[(2-furylmethylamino)methyl]phenol,
CID4279464,
|
| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.241g/mol |
| Monoisotopic Mass | 203.095g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 45.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number