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| CAS Number | 111-27-3 |
| Catalog Number | AG003QX8(AGN-PC-00GQEQ) |
| Chemical Name | Hexyl Alcohol |
| FEMA Number | 2567 |
| IUPAC Name | hexan-1-ol |
| InChI | InChI=1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3 |
| InChI Key | ZSIAUFGUXNUGDI-UHFFFAOYSA-N |
| MDL Number | MFCD00002982 |
| Molecular Formula | C6H14O |
| Molecular Weight | 102.1748 |
| NSC Number | 9254 |
| RTECS Number | MQ4025000 |
| SMILES | OCCCCCC |
| UN Number | 2282 |
| UNII | 6CP2QER8GS |
| Synonyms | 1-hexanol,
1-hexanol, aluminum salt,
1-hexyl alcohol,
n-hexanol,
1-Hexanol,
Hexyl alcohol,
Hexan-1-ol,
111-27-3,
HEXANOL,
n-Hexanol,
n-Hexyl alcohol,
1-Hexyl alcohol,
1-Hydroxyhexane,
Amylcarbinol,
Caproyl alcohol,
Pentylcarbinol,
Caproic alcohol,
n-Hexan-1-ol,
C6 alcohol,
Alcohol(C6),
Hexanol (VAN),
Fatty alcohol(C6),
EPAL 6,
Hexyl alcohol (natural),
Alcohol C-6,
Caswell No. 482E,
FEMA Number 2567,
UNII-6CP2QER8GS,
NSC 9254,
MFCD00002982,
FEMA No. 2567,
Hexanol-(1),
HSDB 565,
EINECS 203-852-3,
6CP2QER8GS,
EPA Pesticide Chemical Code 079047,
BRN 0969167,
HEXYL ALCOHOL, ACTIVE,
AI3-08157,
C6H14O,
CHEBI:87393,
ZSIAUFGUXNUGDI-UHFFFAOYSA-N,
25917-35-5,
DSSTox_CID_1931,
DSSTox_RID_76410,
Hexyl alcohol, 98%, pure,
DSSTox_GSID_21931,
Hexanols,
CAS-111-27-3,
HE2,
Hexyl alcohol, 99%, anhydrous, AcroSeal(R),
hexylalcohol,
Caproalcohol,
Hexalcohol,
Hydroxyhexane,
n-hexylalcohol,
hexanol;,
N-hexenol,
Nat.Hexanol,
Exxal 6,
EINECS 247-346-0,
HEXANOL-CMPD,
Exxal 6 (Salt/Mix),
BDBM9,
1-Hexanol, 98%,
AC1Q2WFM,
AC1Q2WFN,
Hexyl alcohol, FCC, FG,
EC 203-852-3,
AC1L1Q9T,
n-C6H13OH,
SCHEMBL1877,
ACMC-1C26M,
NATURAL HEXYL ALCOHOL,
C6H13OH,
WLN: Q6,
4-01-00-01694 (Beilstein Handbook Reference),
KSC178E1L,
MLS001055374,
UN 2282 (Salt/Mix),
BIDD:ER0298,
CHEMBL14085,
1-Hexanol, analytical standard,
Jsp000849,
DTXSID8021931,
CTK0H8215,
1-Hexanol, anhydrous, >=99%,
NSC9254,
1-Hexanol, reagent grade, 98%,
HMS3039L08,
KS-00000W9Z,
NSC-9254,
ZINC1699882,
Tox21_201335,
Tox21_302953,
ANW-16262,
LMFA05000117,
SBB059899,
STL282713,
UN2282,
AKOS009031422,
EBD2203383,
LS-2366,
MCULE-4299150163,
NE10250,
RL00460,
RTR-002242,
TRA0032352,
Alcohol C-6, Natural, Natural Hexanol,
1-Hexanol, purum, >=98.0% (GC),
NCGC00090949-01,
NCGC00090949-02,
NCGC00256385-01,
NCGC00258887-01,
AN-43058,
CJ-06648,
CJ-28634,
Hexanols [UN2282] [Flammable liquid],
SC-22734,
SMR000677945,
1-Hexanol, SAJ special grade, >=99.0%,
1-Hexanol, Vetec(TM) reagent grade, 98%,
TR-002242,
FT-0607887,
Hexyl alcohol, natural, >=98%, FCC, FG,
ST51046167,
EN300-19338,
1-Hexanol, ReagentPlus(R), >=99.5% (GC),
81323-EP2269986A1,
81323-EP2272817A1,
81323-EP2301919A1,
81323-EP2305687A1,
81323-EP2371805A1,
81323-EP2380568A1,
89674-EP2272842A1,
89674-EP2292613A1,
89674-EP2305033A1,
J-002549,
S14-1473,
F0001-0237,
Z955123546,
InChI=1/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H,
pentilcarbinol,
Amylcarbinols,
Hexahydrophenol,
Hydroxyhexanes,
Amilcarbinol,
Hexalin,
Pentyl carbinol,
Alcohol hexilo,
Capric alcohol,
1-hidroxihexano,
Hexyl Alcohols,
Alcool hexylique,
B-Nonylglucoside,
alcohol n-hexilo,
Alcohols, Hexyl,
Cyclohexan-1-ol,
1-hexilo alcohol,
1-Hydroxy hexane,
CYCLOHEXANOL,
Hexan- 1- ol,
(s)-(+)-hexanol,
Hexyl alcohol (8CI),
hexan - 1 - ol,
HXN (CHRIS Code),
1-Hexanol, aluminum salt,
n-Hexan-1-ol, n-hexanol,
6-BROMOHEXAN-1-OL,
1-Hexanol, 99% 500ml,
N-Hexanol AR 99% 500ml,
CID8103,
n-Hexanol, 99%, SuperDry, J,
1-Hexanol (Langkettige Alkohole),
Hexanol, n-; (n-Hexyl alcohol),
ACN-S002388,
C6-H14-O,
(Hydroxyethyloxy)tri(Ethyloxy)octane,
NA1987,
NA1993,
UN1987,
UN1993,
N-Hexanol 98% for synthesis 500ml,
Hexanol, 98%, extra pure - 1L 1l,
H0130,
C036260,
D000441,
BHL,
HEX,
52019-78-0,
BNG,
C8E,
|
| Complexity | 27.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 102.104g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 102.177g/mol |
| Monoisotopic Mass | 102.104g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
| Symbol: | |
| Hazard Class | 3 |
| Hazard statements | H302-H313-H226-H302+H312-H319 |
| Packing Group | Ⅲ |
| Precautionary statements | P280-P305+P351+P338-P210-P240-P241-P280a-P303+P361+P353-P501a |
| UN Code | UN 2282 |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
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| Test: | Result: |

