CAS 17746-08-6 Pentadecanoyl chloride (HCID 263097)

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Basic information

CAS: 17746-08-6
Standard SMILES: CCCCCCCCCCCCCCC(=O)Cl
InChIKey: PQZWQGNQOVDTRF-UHFFFAOYSA-N
Molecular formula: C15H29ClO
Average molar mass: 260.84 g/mol
Monoisotopic mass: 260.19069323

Names & identifiers

Preferred name: Pentadecanoyl chloride
IUPAC: pentadecanoyl chloride
English name: PENTADECANOYL CHLORIDE
Molecular formula: C15H29ClO
Molecular weight: 260.84

Names & synonyms

Pentadecanoyl chloride17746-08-6DTXSID50294614RefChem:171343DTXCID60245753623-923-6Pentadecanoylchloridepentadecanoic acid chlorideMFCD00045228NSC97420C15H29ClOSCHEMBL1339420

Show more names

PENTADECANOYL CHLORIDE 99%PENTADECANOYL CHLORIDE 98+%PENTADECANOYL CHLORIDE ISO 9001：2015 REACHHexadecanedioic Acid Impurity 16 (Pentadecanoyl Chloride)

PQZWQGNQOVDTRF-UHFFFAOYSA-NNSC-97420AKOS024386330Pentadecanoyl chloride, ~99%, liquidAS-85978Pentadecanoyl chloride, >=98.0% (GC)DB-044299HY-158114

Database identifiers

CAS: 17746-08-6
PubChem CID: 263097
DTXSID: DTXSID50294614
EC Number: 623-923-6
Nikkaji: J110.172B

Properties

Computed structural properties

XLogP: 6.8
Topological polar surface area: 17.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 13
Heavy atoms: 17
Formal charge: 0
Complexity: 168

Physicochemical properties

Boiling point: 173 · 173-175 °C(Press: 7 Torr)
Density: 0.909 g/mL · 0.909 g/mL at 20 °C
refractive index: 20 · n20/D 1.451
storage temp.: 20 °C · −20°C
form: liquid
BRN: 1773803 · 1773803
InChI: 1S/C15H29ClO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17/h2-14H2,1H3
InChIKey: PQZWQGNQOVDTRF-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCC(Cl)=O
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314
Precautionary statements: 280 · P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
PPE: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Corr. 1B (100%)

Safety data

F: 10-21
PPE: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
wgk: 3
ridadr: UN 3265 8/PG 3
risk_code: 34-37
Signal word: Danger
Symbol(GHS): GHS05
hazard_code: C
safety_code: 26-36/37/39-45
hazard_class: 8
Storage Class: 8A - Combustible corrosive hazardous materials
packing_group: III
Hazard statements: H314
Hazard Classifications: Skin Corr. 1B
Precautionary statements: P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405