| CAS Number | 1346819-38-2 |
| Catalog Number | AG00HTS1(AGN-PC-0WD5ZQ) |
| Chemical Name | 1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)propan-2-ol |
| IUPAC Name | 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-2-ol |
| InChI | InChI=1S/C12H21BN2O3/c1-9(16)7-15-8-10(6-14-15)13-17-11(2,3)12(4,5)18-13/h6,8-9,16H,7H2,1-5H3 |
| InChI Key | NMQGFBNAKPAMKE-UHFFFAOYSA-N |
| MDL Number | MFCD22570728 |
| Molecular Formula | C12H21BN2O3 |
| Molecular Weight | 252.1177 |
| SMILES | CC(O)CN1N=CC(B2OC(C)(C)C(C)(C)O2)=C1 |
| Synonyms | 1346819-38-2,
1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)propan-2-ol,
1-[4-(Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]propan-2-ol,
SCHEMBL1485054,
NMQGFBNAKPAMKE-UHFFFAOYSA-N,
KS-000004MJ,
MFCD22570728,
FCH2891765,
SB12189,
AS-53768,
AX8287698,
CS-0052673,
FT-0743804,
A1-09712,
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| Complexity | 296 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.165g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 252.121g/mol |
| Monoisotopic Mass | 252.165g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 56.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number