2-(Aminomethyl)cyclopentan-1-ol

HCID 533887
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Basic information

CAS
874528-11-7
Standard SMILES
NCC1CCCC1O
InChIKey
VORALDSQPSWPRK-UHFFFAOYSA-N
Molecular formula
C6H13NO
Average molar mass
115.17 g/mol
Monoisotopic mass
115.09971404

Names & identifiers

Preferred name
2-(Aminomethyl)cyclopentan-1-ol
IUPAC
2-(aminomethyl)cyclopentan-1-ol
English name
2-(AMinoMethyl)cyclopentanol
Molecular formula
C6H13NO
Molecular weight
115.17

Names & synonyms

2-(aminomethyl)cyclopentan-1-olRefChem:459602819-009-32-(Aminomethyl)cyclopentanol874528-11-7MFCD12190200SCHEMBL2520234Cyclopentanol, 2-(aminomethyl)-DTXSID20336454YQF4828VORALDSQPSWPRK-UHFFFAOYSA-NAKOS009433641
Show more names
2-(aminomethyl)cyclopentan-1-ol, Mixture of diastereomers
SB84525SY188444CS-0260689EN300-75608E85225F672420F2147-1890Z409444212

Database identifiers

CAS
874528-11-7
PubChem CID
533887
DTXSID
DTXSID20336454
EC Number
819-009-3

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
46.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
8

Physicochemical properties

Boiling point
122 °C · 122 °C(Press: 15 Torr)
Density
1.017 g/cm3 · 1.017 g/cm3(Temp: 25 °C)
storage temp.
2 · 2-8°C
solubility
Chloroform (Slightly), Methanol (Slightly)
form
Oil to Semi-Solid
pka
15.11 · 15.11±0.40(Predicted)

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H227 (50%): Combustible liquid [Warning Flammable liquids]

P210, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 4 (50%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS05,GHS07
Hazard statements
H335-H314-H227
Precautionary statements
P210-P260-P264-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P370+P378-P403+P233-P403+P235-P405-P501

Chemistry & industry

Applications

Uses2-(aminomethyl)cyclopentan-1-ol (cas# 874528-11-7) is a useful research chemical used in the preparation of phosphonate-substituted HIV protease inhibitors for treatment of AIDS and other viral infections.

Suppliers14 total

Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
南通菡芳生物科技有限公司[email protected] 18017580634 · [email protected]
海济医药科技（苏州）有限公司18012778619 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
南通敏言生物医药科技有限公司0513-85921823 18662920231 · [email protected]

Related reactions

1 records
New reaction record

Compound notes

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