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1-Butylcyclopentanol

HCID 137019
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
1462-97-1
Standard SMILES
CCCCC1(O)CCCC1
InChIKey
GQTUSXZITATQAM-UHFFFAOYSA-N
Molecular formula
C9H18O
Average molar mass
142.24 g/mol
Monoisotopic mass
142.13576519

Names & identifiers

Preferred name
1-Butylcyclopentanol
IUPAC
1-butylcyclopentan-1-ol
English name
1-Butyl-1-cyclopentanol
Molecular formula
C9H18O
Molecular weight
142.24

Names & synonyms

1-ButylcyclopentanolDTXSID00163306NSC 18908RefChem:75277DTXCID0085797GQTUSXZITATQAM-UHFFFAOYSA-N1462-97-11-butylcyclopentan-1-ol1-Butyl-1-cyclopentanolCyclopentanol, 1-butyl-1-butyl-cyclopentanolMFCD00019283
Show more names
1 -BUTYLCYCLOPENTANOL
1-n-BUTYLCYCLOPENTANOLNSC18908SCHEMBL4443864SCHEMBL6291349NSC-18908AKOS005256404DB-042834

Database identifiers

CAS
1462-97-1
PubChem CID
137019
DTXSID
DTXSID00163306
EC Number
654-950-1
Nikkaji
J920.040A

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
10
Formal charge
0
Complexity
92.9

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302
Precautionary statements
264 · P264-P270-P301+P312-P330-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302
Precautionary statements
P264-P270-P301+P312-P330-P501

Chemistry & industry

Suppliers8 total

Carbone Scientific CO., LTD[email protected]
西格玛奥德里奇(上海)贸易有限公司21-20338288 · [email protected]
CHEMSAMPCO[email protected]
THREEB-MED[email protected]
INFARMATIK-S[email protected]
MPBIO-FINE—
先进技术工业有限公司[email protected]
3B Scientific Corporation[email protected]

Related reactions

1 records
New reaction record
HRID 1261571 reaction equation
HRID 1261571As productuspto-grants-2013_06

Compound notes

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