CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colourless or very pale straw-coloured oily liquid; Faint woody-floral, slightly rose apple aroma |
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Solubility | Soluble in most fixed oils and propylene glycol; slightly soluble in water; insoluble in glycerol |
Density | 0.872-0.879 |
Refractive Index | 1.478-1.483 |
Kovats Retention Index | 1522 1522 1504 1509 1534 1526 1535 1510.4 1512.2 1516.1 1518 1530 1534 1524 1543 1543 1546 1532 1543 1517 1517.1 1585 1533 1539 1564 1546 1560 1547 1521 1536 1527 1514 1504 1525 1530 1570 1521 1524 1510.4 1552 1553 1523 1535 1512 1536 1512 1533 1514 1526 1524 1530 1550 1551 |
COMPUTED DESCRIPTORS
Molecular Weight | 222.37 g/mol |
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XLogP3 | 4.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 7 |
Exact Mass | 222.198365449 g/mol |
Monoisotopic Mass | 222.198365449 g/mol |
Topological Polar Surface Area | 20.2 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 269 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
(6Z)-nerolidol is a nerolidol in which the double bond at position 6 adopts a cis-configuration.