2-(1-Methylethoxy)benzenamine

HCID 34436
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Basic information

CAS
29026-74-2
Standard SMILES
CC(C)Oc1ccccc1N
InChIKey
PZOZYLSYQJYXBI-UHFFFAOYSA-N
Molecular formula
C9H13NO
Average molar mass
151.21 g/mol
Monoisotopic mass
151.09971404

Names & identifiers

Preferred name
2-(1-Methylethoxy)benzenamine
IUPAC
2-propan-2-yloxyaniline
English name
2-isopropoxyaniline
Molecular formula
C9H13NO
Molecular weight
151.21

Names & synonyms

2-Isopropoxyaniline29026-74-2Benzenamine, 2-(1-methylethoxy)-o-Isopropoxyaniline2-(1-Methylethoxy)benzenamineOrtho-isopropoxyaniline8M3MFC22JXDTXSID20183268RefChem:87718DTXCID30105759249-377-52-(propan-2-yloxy)aniline
Show more names
ANILINE, o-ISOPROPOXY-2-(1-Methylethoxy)anilineo-Izopropoksyanilina [Polish](2-isopropoxyphenyl)amine sulfate(2-isopropoxyphenyl)amine(SALTDATA: HCl)
2-Isopropoxy-phenylamine2-propan-2-yloxyanilineo-IpaMFCD00242947o-Izopropoksyanilina2-isopropoxyaniline sulfate2-(methylethoxy)phenylamine0-isopropoxyaniline

Database identifiers

CAS
29026-74-2
PubChem CID
34436
DTXSID
DTXSID20183268
UNII
8M3MFC22JX
EC Number
249-377-5
Nikkaji
J286.504A

Properties

Computed structural properties

XLogP
2
Topological polar surface area
35.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
11

Physicochemical properties

Melting point
139 · 139-141℃
Boiling point
273.23 °C · 273.23°C (rough estimate)
Density
1.0406 · 1.0406 (rough estimate)
refractive index
1.538 · 1.5380 (estimate)
storage temp.
2 · 2-8°C(protect from light)
form
solid

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, 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.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

Safety data

wgk
WGK 3
hs_code
2922290090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_class
IRRITANT
Storage Class
11 - Combustible Solids

Chemistry & industry

Upstream & downstream products

Suppliers65 total

陕西凯尔凯医药科技有限公司029-2148545164 17392779578 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Henan Rane Chemical Co., Ltd.+86-18738066252 · [email protected]

Related reactions

20 records
New reaction record

Compound notes

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