Basic information
- CAS
62783-48-6- Standard SMILES
Cc1ccccc1CN(C)N=O- InChIKey
RRXABZCVYQNCRE-UHFFFAOYSA-N- Molecular formula
- C9H12N2O
- Average molar mass
- 164.2 g/mol
- Monoisotopic mass
- 164.09496301
Overview
structure given in first source
Names & identifiers
- Preferred name
- N-Methyl-N-nitroso-(2-methylphenyl)methylamine
- IUPAC
- N-methyl-N-[(2-methylphenyl)methyl]nitrous amide
- English name
- N-methyl-N-nitroso-(2-methylphenyl)methylamine
- Molecular formula
- C9H12N2O
- Molecular weight
- 164.2
Names & synonyms
62783-48-6N-Methyl-N-nitroso-(2-methylphenyl)methylamineDTXSID20211853N-methyl-N-(2-methylbenzyl)nitrosamineRefChem:1637592-MMBNADTXCID50134344N-Methyl-N-(2-methylbenzyl)nitrous AmideN,2-DIMETHYL-N-NITROSOBENZENEMETHANAMINEN-Nitroso-N-(2-methylbenzyl)-methylaminNSC-114485N-methyl-N-[(2-methylphenyl)methyl]nitrous amide
Show more names
Methyl(2-methylbenzyl)nitrosamineN-Nitroso-N-(2-methylbenzyl)-methylamine
N-Nitroso-N-(2-methylbenzyl)methylamineN-Nitroso-N-(2-methylbenzyl)-methylamin [German]NSC114485Crotamiton Impurity 34Nitrosamines Impurity 7Benzenemethanamine, N,2-dimethyl-N-nitroso-BENZYLAMINE, N,o-DIMETHYL-N-NITROSO-6D6HL34NL6
Database identifiers
- CAS
62783-48-6- PubChem CID
- 44159
- DTXSID
DTXSID20211853- UNII
- 6D6HL34NL6
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- Boiling point
- 291.67 °C · 291.67°C (rough estimate)
- Density
- 1.1062 · 1.1062 (rough estimate)
- refractive index
- 1.5373 · 1.5373 (estimate)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Toxicity
- 50 orl-rat: · LD50 orl-rat: 90 mg/kg ZKKOBW 88,231,77
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
- Toxicity
- LD50 orl-rat: 90 mg/kg ZKKOBW 88,231,77
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers5 total
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
杭州云易国科生物科技有限公司18457506494 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
上海康满林生物医药有限公司68080707 15021879576 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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