| CAS Number | 1207754-99-1 |
| Catalog Number | AG00HFQW(AGN-PC-0WCKYZ) |
| Chemical Name | (2R)-1-Boc-2-methylpyrrolidine-2-methanol |
| IUPAC Name | tert-butyl (2R)-2-(hydroxymethyl)-2-methylpyrrolidine-1-carboxylate |
| InChI | InChI=1S/C11H21NO3/c1-10(2,3)15-9(14)12-7-5-6-11(12,4)8-13/h13H,5-8H2,1-4H3/t11-/m1/s1 |
| InChI Key | VTUUHTGTUIJRSA-LLVKDONJSA-N |
| MDL Number | MFCD23106114 |
| Molecular Formula | C11H21NO3 |
| Molecular Weight | 215.2893 |
| SMILES | OC[C@]1(C)N(C(OC(C)(C)C)=O)CCC1 |
| Synonyms | (2R)-1-Boc-2-methylpyrrolidine-2-methanol,
1207754-99-1,
(R)-tert-butyl 2-(hydroxymethyl)-2-methylpyrrolidine-1-carboxylate,
TERT-BUTYL (2R)-2-(HYDROXYMETHYL)-2-METHYLPYRROLIDINE-1-CARBOXYLATE,
SCHEMBL8950858,
KS-000007MW,
MFCD23106114,
ZINC82370292,
PB37311,
SB20891,
AS-51822,
DA-14409,
CS-0048648,
FT-0771404,
Q-3242,
(2R)-1-Boc-2-(hydroxymethyl)-2-methylpyrrolidine,
tert-butyl (2S)-2-(hydroxymethyl)-2-methylpyrrolidine-1-carboxylate,
1339022-10-4,
|
| Complexity | 247 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.293g/mol |
| Monoisotopic Mass | 215.152g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H317
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Packing Group
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Precautionary statements
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P280
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UN Code
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Certificate of Analysis
Lot Number