CAS Number626-89-1
Synonyms4-methylpentan-1-ol; AnglaMol 6085U; EINECS 210-969-3; 4-METHYLPENTANOL-1; 4-methylpentyl alcohol; 2-Methyl-5-pentanol; 4-Methylpcntanol; ISOHEXANOL; 4-methyl-1-pentano; 4-methylpentanol; iso-hexyl alcohol; MFCD00002962; ISOAMYL CARBINOL
Molecular Formula(CH3)2CH(CH2)3OH
Molecular Weight102.17
Purity97%
Density0.821 g/mL at 25 °C(lit.)
Boiling Point160-165 °C (lit.)
Appearanceliquid
EINECS210-969-3
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 626-89-1 |
| Catalog No. | 2A-9024527 |
| Chinese Name | 4-甲基-1-戊醇 |
| Synonyms | 4-methylpentan-1-ol; AnglaMol 6085U; EINECS 210-969-3; 4-METHYLPENTANOL-1; 4-methylpentyl alcohol; 2-Methyl-5-pentanol; 4-Methylpcntanol; ISOHEXANOL; 4-methyl-1-pentano; 4-methylpentanol; iso-hexyl alcohol; MFCD00002962; ISOAMYL CARBINOL |
| Molecular Formula | (CH3)2CH(CH2)3OH |
| Molecular Weight | 102.17 |
| Purity | 97 |
| Density | 0.821 g/mL at 25 °C(lit.) |
| Boiling Point | 160-165 °C (lit.) |
| Appearance | liquid |
| Storage Condition | Store in an airtight container in a cool, dry plac |
| Packaging | III |
| Application | 4-Methyl-1-pentanol (Isohexanol) is a volatile aroma component of red wine. |
| EINECS | 210-969-3 |
| PubChem ID | 24897106 |
| MDL Number | MFCD00002962 |
| SMILES | CC(C)CCCO |
| InChI | 1S/C6H14O/c1-6(2)4-3-5-7/h6-7H,3-5H2,1-2H3 |
| InChI Key | PCWGTDULNUVNBN-UHFFFAOYSA-N |
| Beilstein/REAXYS | 1731303 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | 3.2 |
| MSDS | msds/24527_1_626_89_1.pdf |
| Bioactivity | 4-Methyl-1-pentanol (Isohexanol) is a volatile aroma compound of red wine from cv. Kalecik Karasι[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others References [1]. Selli S, et, al. Volatile composition of red wine from cv. Kalecik Karasι grown in central Anatolia Chemical & Physical Properties Density 0.821 g/mL at 25 °C(lit.) Boiling Point 160-165 °C(lit.) Molecular Formula C6H14O Molecular Weight 102.17500 Flash Point 125 °F Exact Mass 102.10400 PSA 20.23000 LogP 1.41490 Index of Refraction n20/D 1.414(lit.) InChIKey PCWGTDULNUVNBN-UHFFFAOYSA-N SMILES CC(C)CCCO Storage condition Flammables area |
| Use of | 4-Methyl-1-pentanol (Isohexanol) is a volatile aroma compound of red wine from cv. Kalecik Karasι[1]. Properties Name 4-Methyl-1-pentanol Synonym More Synonyms 4-Methyl-1-pentanol Biological Activity Description 4-Methyl-1-pentanol (Isohexanol) is a volatile aroma compound of red wine from cv. Kalecik Karasι[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others References [1]. Selli S, et, al. Volatile composition of red wine from cv. Kalecik Karasι grown in central Anatolia Chemical & Physical Properties Molecular Formula C6H14O Exact Mass 102.10400 PSA 20.23000 LogP 1.41490 InChIKey PCWGTDULNUVNBN-UHFFFAOYSA-N SMILES CC(C)CCCO Storage condition Flammables area |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Danger Regulations: 1987 International Maritime Transport Danger Regulations: 1987 International Air Transport Danger Regulations: 1987 14.2 United Nations shipping name European Land Transport Dangerous Regulations: ALCOHOLS, N.O.S. (4-Methylpentan-1-ol) IMDG Code: ALCOHOLS, N.O.S. (4-Methylpentan-1-ol) International Air Transport Regulations: Alcohols, n.o.s. (4-Methylpentan-1-ol) 14.3 Transport hazard categories European land transport Dangerous Regulations: 3 International sea transport Dangerous Regulations: 3 International air transport Dangerous Regulations: 3 14.4 Package group European Land Transport Danger Regulations: III International Maritime Transport Danger Regulations: III International Air Transport Danger Regulations: III 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
| Related Products in Specialty Chemicals | ||
|---|---|---|
| Propyl hexanoate | 626-77-7 | 2A-9024522 |
| Butyl hexanoate | 626-82-4 | 2A-9024523 |
| Monoethyl Adipate | 626-86-8 | 2A-9024524 |
| 1,4-Dibromopentane | 626-87-9 | 2A-9024525 |
| 1-Bromo-4-methylpentane | 626-88-0 | 2A-9024526 |
| N-Propylurea | 627-06-5 | 2A-9024530 |
| 3-Buten-1-ol | 627-27-0 | 2A-9024533 |
| N-Methylpropylamine | 627-35-0 | 2A-9024537 |
| N-Methylallylamine | 627-37-2 | 2A-9024538 |
| 3-Methoxy-1-propene | 627-40-7 | 2A-9024539 |
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