Basic information
- CAS
113582-42-6- Standard SMILES
CC(C)(C)C(N)C(N)=O- InChIKey
QCVCCWSPZIUXEA-UHFFFAOYSA-N- Molecular formula
- C6H14N2O
- Average molar mass
- 130.19 g/mol
- Monoisotopic mass
- 130.11061307
Names & identifiers
- Preferred name
- 2-Amino-3,3-dimethylbutanamide
- IUPAC
- 2-amino-3,3-dimethylbutanamide
- English name
- DL-tert-Leucinamide
- Molecular formula
- C6H14N2O
- Molecular weight
- 130.19
Names & synonyms
2-amino-3,3-dimethylbutanamide113582-42-6Butanamide, 2-amino-3,3-dimethyl-dl-tert-leucine amide3-methylvalinamidetert-Leucinamide, DL-1H8RV3N0FHUNII-1H8RV3N0FH(2RS)-2-Amino-3,3-dimethylbutanamideButanamide, 2-amino-3,3-dimethyl-, (2RS)-2-Amino-3,3-dimethylbutanamide;2-amino-3,3-dimethyl-butanamide
Show more names
DL-tert-Leucinamide2-Amino-3,3-dimethylbutanediol
dl-t-leucine amideD,L-tert-leucine amideDL-tertiary leucine amideSCHEMBL1534982SCHEMBL7769267DTXSID703930372-Amino-3,3-dimethyl-butyramideMFCD14625456
Database identifiers
- CAS
113582-42-6- PubChem CID
- 3496444
- DTXSID
DTXSID70393037- UNII
- 1H8RV3N0FH
- Nikkaji
- J2.190.932G
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 69.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 115
Physicochemical properties
- Boiling point
- 242.7 · 242.7±23.0 °C(Predicted)
- Density
- 0.982 · 0.982±0.06 g/cm3(Predicted)
- pka
- 16.19 · 16.19±0.50(Predicted)
- FDA UNII
- 1 H8RV3N0FH · 1H8RV3N0FH
Chemistry & industry
Applications
UsesDL-tert-Leucine Amide is an intermediate in the synthesis of ADB-FUBINACA (A234000), a synthetic cannabinoid that is used as a designer drug in illegal products.
Suppliers11 total
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
雷丁试剂0510-85629785 18013409632 · [email protected]
合肥前杭医药科技有限公司13346199520 · [email protected]
河南伊诺凯新材料有限公司15565215982 15565215982 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
湖北中隆康盛精细化工有限公司027-027-83850178 18162590268 · [email protected]
Mainchem Co., Ltd.+86-86-05926210733 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
DONBOO AMINO ACID COMPANY13063595538 · [email protected]
Dideu Industries Group Limited+8617392712697 · [email protected]
Related reactions
9 records
Compound notes
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