6-Heptyn-1-ol
Properties
- Molecular formula
- C7H12O
- Molar mass
- 112.17 g/mol
- Exact mass
- 112.0888 Da
- logP
- 1.17Crippen estimate
- Polar surface area
- 20.2 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 4
Hazards
Warning
- H226 Flammable liquid and vapor50% of notifiers
- H227 Combustible liquid50% of notifiers
- H315 Causes skin irritation50% of notifiers
- H319 Causes serious eye irritation50% of notifiers
- H335 May cause respiratory irritation50% of notifiers
Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
63478-76-2SMILES
C#CCCCCCOInChIKey
BVRCLEXKQNWTDK-UHFFFAOYSA-NInChI
InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h1,8H,3-7H2Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 6-Heptyn-1-ol
Similar compounds
10-Undecyn-1-ol2774-84-7100 % similar
7-Octyn-1-ol871-91-0100 % similar
5-Hexyn-1-ol928-90-594 % similar
4-Pentyn-1-ol5390-04-579 % similar
1,9-Decadiyne1720-38-367 % similar
1,8-Nonadiyne2396-65-867 % similar
1,7-Octadiyne871-84-161 % similar
3-Butyn-1-ol927-74-260 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds