| CAS Number | 892582-00-2 |
| Catalog Number | AG0087WV(AGN-PC-0WB54B) |
| Chemical Name | 2-[(2-Furylmethyl)amino]-1-butanol |
| IUPAC Name | 2-(furan-2-ylmethylamino)butan-1-ol |
| InChI | InChI=1S/C9H15NO2/c1-2-8(7-11)10-6-9-4-3-5-12-9/h3-5,8,10-11H,2,6-7H2,1H3 |
| InChI Key | BCWSSYQZJXXNJK-UHFFFAOYSA-N |
| MDL Number | MFCD07410477 |
| Molecular Formula | C9H15NO2 |
| Molecular Weight | 169.2209 |
| SMILES | CCC(NCC1OC=CC=1)CO |
| Synonyms | 892582-00-2,
2-[(2-FURYLMETHYL)AMINO]-1-BUTANOL,
2-((Furan-2-ylmethyl)amino)butan-1-ol,
AC1NGE0I,
CTK5G2725,
DTXSID30406016,
CHEMBRDG-BB 9071151,
MFCD07410477,
2-(furan-2-ylmethylamino)butan-1-ol,
AKOS002619536,
AKOS017274978,
MCULE-2290168008,
2-{[(Furan-2-yl)methyl]amino}butan-1-ol,
Y-3060,
CHEMBRDG-BB9071151,
2-(2-furylmethylamino)butan-1-ol,
CID4722612,
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| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.224g/mol |
| Monoisotopic Mass | 169.11g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 45.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number