Basic information
- CAS
6627-72-1- Standard SMILES
CC1(C)[C@@H]2CC[C@]1(C)[C@H](O)C2- InChIKey
DTGKSKDOIYIVQL-UHFFFAOYSA-N- Molecular formula
- C10H18O
- Average molar mass
- 154.25 g/mol
- Monoisotopic mass
- 154.13576519
Overview
See also: Borneol (annotation moved to); Isoborneol (annotation moved to); Borneol, (-)- (annotation moved to) ... View More ...
Names & identifiers
- Preferred name
- Npc189036
- IUPAC
- (1S,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
- English name
- Borneol oil
- Molecular formula
- C10H18O
- Molecular weight
- 154.25
Names & synonyms
RefChem:1092819Npc189036NSC26352DL-IsoborneolBORNEOL, (L)d-2-BornanolDL-2-BornanolSCHEMBL115723NSC60223NSC-26352AKOS015913994Bicyclo[2.2.1]heptan-2-ol,7,7-trimethyl-, endo-(.+-.)-
Show more names
DL-BORNEOL(±)-Isoborneol6R)-1Synthetic LobeliaNatural borneol oilBorneol oilBorneol oil1,7,7-TRIMETHYLNORBORNAN-2-OL7-Trimethylbicyclo[2.2.1]heptan-6-ol
Database identifiers
- CAS
6627-72-1- PubChem CID
- 10049
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 185
Physicochemical properties
- Melting point
- 208 °C · 208°C
- Boiling point
- 217.64 °C · 217.64°C (rough estimate)
- Density
- 1.011 · 1.0110
- refractive index
- 1.4586 · 1.4586 (estimate)
- InChI
- InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3
- InChIKey
- DTGKSKDOIYIVQL-UHFFFAOYSA-N
- SMILES
- C1(O)C2(C)C(C)(C)C(CC2)C1
- NIST Chemistry Reference
- DL-Borneol(6627-72-1)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers72 total
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
上海纯优生物科技有限公司15921393123 18302135232 · [email protected]
广州纳珑化工有限公司13192879270; 13192879270 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
武汉绿景丰华生物科技有限公司19972070065 · [email protected]
吉安市国光香料厂18607067153 18607067153
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
广东元丰化学试剂有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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