(1S,2S)-(-)-1,2-Diaminocyclohexane D-tartrate - CAS 67333-70-4
Catalog: |
BB033252 |
Product Name: |
(1S,2S)-(-)-1,2-Diaminocyclohexane D-tartrate |
CAS: |
67333-70-4 |
Synonyms: |
(1S,2S)-cyclohexane-1,2-diamine;(2S,3S)-2,3-dihydroxybutanedioic acid; (1S,2S)-cyclohexane-1,2-diamine;(2S,3S)-2,3-dihydroxybutanedioic acid |
IUPAC Name: | (1S,2S)-cyclohexane-1,2-diamine;(2S,3S)-2,3-dihydroxybutanedioic acid |
Description: | (1S,2S)-(-)-1,2-Diaminocyclohexane D-tartrate (CAS# 67333-70-4) is a useful research chemical. |
Molecular Weight: | 264.28 |
Molecular Formula: | C10H20N2O6 |
Canonical SMILES: | C1CCC(C(C1)N)N.C(C(C(=O)O)O)(C(=O)O)O |
InChI: | InChI=1S/C6H14N2.C4H6O6/c7-5-3-1-2-4-6(5)8;5-1(3(7)8)2(6)4(9)10/h5-6H,1-4,7-8H2;1-2,5-6H,(H,7,8)(H,9,10)/t5-,6-;1-,2-/m00/s1 |
InChI Key: | GDOTUTAQOJUZOF-SCDVTJNCSA-N |
Boiling Point: | 399.3 °C at 760 mmHg |
Melting Point: | 284 °C dec. |
Purity: | 99 % |
Appearance: | Powder or crystalline powder |
Storage: | Inert atmosphere. Room Temperature. |
MDL: | MFCD00191980 |
LogP: | -0.50700 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501 |
Signal Word: | Warning |
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Complexity: | 197 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 4 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 264.13213636 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 8 |
Hydrogen Bond Donor Count: | 6 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 264.13213636 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 167 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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