| CAS Number | 1044919-31-4 |
| Catalog Number | AG008TUZ(AGN-PC-0D005R) |
| Chemical Name | (5-Methoxypyridin-3-yl)methanamine |
| IUPAC Name | (5-methoxypyridin-3-yl)methanamine |
| InChI | InChI=1S/C7H10N2O/c1-10-7-2-6(3-8)4-9-5-7/h2,4-5H,3,8H2,1H3 |
| InChI Key | HODRJLWIXVIVOC-UHFFFAOYSA-N |
| MDL Number | MFCD07345678 |
| Molecular Formula | C7H10N2O |
| Molecular Weight | 138.1671 |
| SMILES | NCC1=CC(OC)=CN=C1 |
| Synonyms | (5-METHOXYPYRIDIN-3-YL)METHANAMINE,
1044919-31-4,
3-Pyridinemethanamine, 5-methoxy-,
SCHEMBL2681872,
HODRJLWIXVIVOC-UHFFFAOYSA-N,
KS-000006OY,
MFCD13189000,
ZINC82410667,
AKOS017514876,
PB36726,
SB19962,
AS-34333,
AJ-125341,
CS-0053144,
Q-1787,
|
| Complexity | 97.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 138.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 138.17g/mol |
| Monoisotopic Mass | 138.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
8
|
|
Hazard statements
|
H314
|
|
Packing Group
|
Ⅱ
|
|
Precautionary statements
|
P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P405-P501
|
|
UN Code
|
UN 2735
|
Certificate of Analysis
Lot Number