| CAS Number | 949226-57-7 |
| Catalog Number | AG00J2E8(AGN-PC-0WB5VJ) |
| Chemical Name | 3-Amino-2-(furan-2-ylmethyl)propan-1-ol |
| IUPAC Name | 2-(aminomethyl)-3-(furan-2-yl)propan-1-ol |
| InChI | InChI=1S/C8H13NO2/c9-5-7(6-10)4-8-2-1-3-11-8/h1-3,7,10H,4-6,9H2 |
| InChI Key | YJBJHOJKHDSICH-UHFFFAOYSA-N |
| MDL Number | MFCD09802078 |
| Molecular Formula | C8H13NO2 |
| Molecular Weight | 155.1943 |
| SMILES | C1(CC(CO)CN)=CC=CO1 |
| Synonyms | 949226-57-7,
3-amino-2-(2-furylmethyl)propan-1-ol,
3-AMINO-2-(2-FURYLMETHYL)-1-PROPANOL,
3-Amino-2-(furan-2-ylmethyl)propan-1-ol,
AC1Q53MK,
CTK7E3161,
MFCD09802078,
SBB084474,
AKOS000200969,
AKOS016042179,
MCULE-4198447918,
3-amino-2-[(furan-2-yl)methyl]propan-1-ol,
EN300-28818,
Y-5511,
Z278210628,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.197g/mol |
| Monoisotopic Mass | 155.095g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 59.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number