| CAS Number | 912771-31-4 |
| Catalog Number | AG00GVVP(AGN-PC-0207AC) |
| Chemical Name | 1-(1,3-Dimethylpyrrolidin-3-yl)methanamine |
| IUPAC Name | (1,3-dimethylpyrrolidin-3-yl)methanamine |
| InChI | InChI=1S/C7H16N2/c1-7(5-8)3-4-9(2)6-7/h3-6,8H2,1-2H3 |
| InChI Key | HBEGEQPEVWXGGD-UHFFFAOYSA-N |
| MDL Number | MFCD09055201 |
| Molecular Formula | C7H16N2 |
| Molecular Weight | 128.2153 |
| SMILES | N1(C)CCC(C)(CN)C1 |
| Synonyms | (1,3-dimethylpyrrolidin-3-yl)methanamine,
912771-31-4,
1-(1,3-Dimethylpyrrolidin-3-yl)methanamine,
SCHEMBL10691941,
DTXSID80595787,
MFCD09055201,
AKOS000558514,
AKOS022184946,
MCULE-9613475968,
SB11628,
1-(1,3-Dimethyl-3-pyrrolidinyl)methanamine,
CS-0054043,
C-(1,3-Dimethyl-pyrrolidin-3-yl)-methylamine,
Y-5038,
1-(1,3-Dimethylpyrrolidin-3-yl)methanamine, AldrichCPR,
|
| Complexity | 103 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 128.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 128.219g/mol |
| Monoisotopic Mass | 128.131g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
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Certificate of Analysis
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