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2-(6-Methoxy-1H-benzimidazol-2-yl)ethan-1-amine

HCID 24252557
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
4078-55-1
Standard SMILES
COc1ccc2nc(CCN)[nH]c2c1
InChIKey
FBEXKNOXRQGGCX-UHFFFAOYSA-N
Molecular formula
C10H13N3O
Average molar mass
191.234 g/mol
Monoisotopic mass
191.10586204

Names & identifiers

Preferred name
2-(6-Methoxy-1H-benzimidazol-2-yl)ethan-1-amine
IUPAC
2-(6-Methoxy-1H-benzimidazol-2-yl)ethan-1-amine
English name
2-Aminoethyl-5(6)-methoxy-benzimidazole
Molecular formula
C10H13N3O
Molecular weight
191.23

Names & synonyms

2-Aminoethyl-5(6)-methoxy-benzimidazole2-(6-methoxy-1H-benzimidazol-2-yl)ethanamine:dihydrochloride2-(5-Methoxy-1H-benzo[d]imidazol-2-yl)ethanamine dihydrochloride2-(2-Methyl-1H-benzo[d]imidazol-1-yl)acetic acid hydrochloride2-(5-Methoxy-1H-benzo[d]imidazol-2-yl)ethanamine dihydrochloride

Database identifiers

CAS
4078-55-1
PubChem CID
24252557
DTXSID
DTXSID40640505
ChEMBL
CHEMBL4585450
EC Number
809-272-2

Properties

Physicochemical properties

Melting point
235 · 235-236 °C
form
solid
InChI
1S/C10H10N2O2.ClH/c1-7-11-8-4-2-3-5-9(8)12(7)6-10(13)14;/h2-5H,6H2,1H3,(H,13,14);1H
InChIKey
VJCYHNKNDZZIGV-UHFFFAOYSA-N
SMILES
O=C(O)CN1C(C)=NC2=CC=CC=C12.Cl
UNSPSC Code
12352116 · 12352116
NACRES
21 · NA.21
Symbol(GHS)
5 · GHS05
Signal word
Danger
Hazard statements
318 · H318
Precautionary statements
280 · P280-P305+P351+P338+P310
Hazard Codes
Xi
WGK Germany
3 · WGK 3
Storage Class
11 · 11 - Combustible Solids

Safety & regulation

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

Safety data

wgk
WGK 3
Signal word
Danger
Symbol(GHS)
GHS05
hazard_code
Xi
Storage Class
11 - Combustible Solids
Hazard statements
H318
Precautionary statements
P280-P305+P351+P338+P310

Chemistry & industry

Suppliers3 total

郑州汇聚化工有限公司13393710386 · [email protected]
上海海皋科技有限公司021-57646680 18306277365 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]

Related reactions

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Compound notes

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