Basic information
- CAS
5635-67-6- Standard SMILES
CNCc1ccc(Cl)c(Cl)c1- InChIKey
XOEHPEYVNJXYEN-UHFFFAOYSA-N- Molecular formula
- C8H9Cl2N
- Average molar mass
- 190.07 g/mol
- Monoisotopic mass
- 189.0112047
Names & identifiers
- Preferred name
- [(3,4-Dichlorophenyl)methyl](methyl)amine
- IUPAC
- 1-(3,4-dichlorophenyl)-N-methylmethanamine
- English name
- (3,4-Dichlorobenzyl)methylamine
- Molecular formula
- C8H9Cl2N
- Molecular weight
- 190.07
Names & synonyms
[(3,4-dichlorophenyl)methyl](methyl)amine((3,4-dichlorophenyl)methyl)(methyl)amineRefChem:389932820-677-35635-67-6N-Methyl-3,4-dichlorobenzylamine(3,4-Dichlorobenzyl)methylamine1-(3,4-dichlorophenyl)-N-methylmethanaminen-(3,4-dichlorobenzyl)-n-methylamineBenzenemethanamine, 3,4-dichloro-N-methyl-MFCD00013624CHEMBL1178112
Show more names
1-(3,4-Dichlorophenyl)Olanexidine Impurity 73,4-DICHLORO-N-METHYLBENZYLAMINE(3,4-DICHLOROBENZYL)METHYLAMINE 95%N-(3,4-Dichlorobenzyl)-N-methylamine ,97%(3,4-dichlorophenyl)methyl-methylammonium
1-(3,4-dichlorophenyl)-N-methyl-methanamine1-(34-Dichlorophenyl)-N-methylmethanamine(3,4-dichlorophenyl)-N-methylmethanamineSCHEMBL298380SCHEMBL1352359SCHEMBL4573627SCHEMBL30139650SCHEMBL30139651
Database identifiers
- CAS
5635-67-6- PubChem CID
- 485436
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 119
Physicochemical properties
- Boiling point
- 146 °C · 146 °C(Press: 47 Torr)
- Density
- 1.226 · 1.226±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 8.77 · 8.77±0.10(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Symbol(GHS)
- 7 · GHS07
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 233 · P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
- HS Code
- 2921490090 · 2921490090
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H334 (100%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P233, P260, P261, P264, P264+P265, P270, P271, P280, P284, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P342+P316, P362+P364, 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 CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；Resp. Sens. 1 (100%)；STOT SE 3 (100%)
Safety data
- hs_code
- 2921490090
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers62 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
Aladdin Scientific[email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
Related reactions
2 records
Compound notes
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