(3S)-3-(2-methylpropyl)morpholine

HCID 28064342
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Basic information

CAS
77897-22-4
Standard SMILES
CC(C)C[C@H]1COCCN1
InChIKey
INIRYZSIQPENMR-QMMMGPOBSA-N
Molecular formula
C8H17NO
Average molar mass
143.23 g/mol
Monoisotopic mass
143.13101417

Names & identifiers

Preferred name
(3S)-3-(2-methylpropyl)morpholine
IUPAC
(3S)-3-(2-methylpropyl)morpholine
English name
(S)-3-Isobutylmorpholine
Molecular formula
C8H17NO
Molecular weight
143.23

Names & synonyms

77897-22-4(3S)-3-(2-METHYLPROPYL)MORPHOLINEDTXSID40650927RefChem:208245DTXCID00601677869-633-5(S)-3-IsobutylmorpholineMorpholine,3-(2-methylpropyl)-, (3S)-MFCD11519110(3S)-3-ISOBUTYLMORPHOLINE(S)-3-iso-butylmorpholineSCHEMBL1005896
Show more names
(S)-3-Isobutylmorpholine HCl(S)-3-Isobutylmorpholine HydrochlorideMorpholine, 3-(2-methylpropyl)-, (3S)-
INIRYZSIQPENMR-QMMMGPOBSA-NAKOS016845976AS-40697DB-075384CS-0218048EN300-99045F329627

Database identifiers

CAS
77897-22-4
PubChem CID
28064342
DTXSID
DTXSID40650927
EC Number
869-633-5

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
21.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
10

Physicochemical properties

Boiling point
197.2 · 197.2±15.0 °C(Predicted)
Density
0.87 · 0.870±0.06 g/cm3(Predicted)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
pka
9.03 · 9.03±0.40(Predicted)
Symbol(GHS)
7 · GHS07,GHS05
Signal word
Danger

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H227 (100%): Combustible liquid [Warning Flammable liquids]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 4 (100%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS07,GHS05
Hazard statements
H315-H335-H318-H227
Precautionary statements
P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P210-P280-P370+P378-P403+P235-P501

Chemistry & industry

Suppliers9 total

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
南通先行生物医药科技有限公司513-85982855 18921614129 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海馨远医药科技有限公司021-24206007 13764915196 · [email protected]

Related reactions

1 records
New reaction record

Compound notes

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