| CAS Number | 1207541-15-8 |
| Catalog Number | AG003A78(AGN-PC-0WCKJQ) |
| Chemical Name | (R)-(1-Methylpyrrolidin-3-yl)methanamine |
| IUPAC Name | [(3R)-1-methylpyrrolidin-3-yl]methanamine |
| InChI | InChI=1S/C6H14N2/c1-8-3-2-6(4-7)5-8/h6H,2-5,7H2,1H3/t6-/m1/s1 |
| InChI Key | BAOBZCAXECCBQL-ZCFIWIBFSA-N |
| MDL Number | MFCD23106375 |
| Molecular Formula | C6H14N2 |
| Molecular Weight | 114.1888 |
| SMILES | CN1C[C@H](CC1)CN |
| Synonyms | 1207541-15-8,
(R)-(1-Methylpyrrolidin-3-yl)methanamine,
[(3R)-1-methylpyrrolidin-3-yl]methanamine,
(R)-1-Methyl-3-(aminomethyl)pyrrolidine,
SCHEMBL1858281,
ZINC2559669,
MFCD23106375,
FCH1960751,
PB35492,
SB10737,
KS-0000041S,
AJ-40315,
AK170788,
AS-51875,
CS-0053048,
(1-methylpyrrolidin-3-yl)methanamine,
(S)-1-Methyl-3-(aminomethyl)pyrrolidine,
[(3S)-1-methylpyrrolidin-3-yl]methanamine,
1419075-98-1,
13005-11-3,
|
| Complexity | 72.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 114.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 114.192g/mol |
| Monoisotopic Mass | 114.116g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.3A^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-H318
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P280-P305+P351+P338-P310
|
|
UN Code
|
UN 2735
|
Certificate of Analysis
Lot Number