Basic information
- CAS
2893-05-2- Standard SMILES
CC(C)C(=O)Cc1ccccc1- InChIKey
ZATIMOAGKJEVGN-UHFFFAOYSA-N- Molecular formula
- C11H14O
- Average molar mass
- 162.23 g/mol
- Monoisotopic mass
- 162.10446507
Names & identifiers
- Preferred name
- Benzyl isopropyl ketone
- IUPAC
- 3-methyl-1-phenylbutan-2-one
- English name
- 3-Methyl-1-phenyl-2-butanone
- Molecular formula
- C11H14O
- Molecular weight
- 162.23
Names & synonyms
2893-05-23-Methyl-1-phenyl-2-butanoneBenzyl isopropyl ketone2-Butanone, 3-methyl-1-phenyl-Isopropylbenzyl ketone81804S3MKMNSC-4069261-PHENYL-3-METHYLBUTANE-2-ONEUNII-81804S3MKMDTXSID40183129EINECS 220-765-6NSC 406926
Show more names
Benzyl #niso-propyl ketone3-Methyl-1-phenyl-2-butanone, 96%,
AI3-11066RefChem:118877DTXCID00105620220-765-6ZATIMOAGKJEVGN-UHFFFAOYSA-N3-Methyl-1-phenylbutan-2-one1-phenyl-3-methyl-2-butanoneMFCD00040487
Database identifiers
- CAS
2893-05-2- PubChem CID
- 76163
- DTXSID
DTXSID40183129- UNII
- 81804S3MKM
- EC Number
- 220-765-6
- Nikkaji
- J47.908J
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 143
Physicochemical properties
- Boiling point
- 237 · 237-240°C
- Density
- 0 · 0,968 g/cm3
- refractive index
- 1.504 · 1.5040
- Flash point
- 237 · 237-240°C
- storage temp.
- Sealed in dry,Room Temperature
- form
- clear liquid
- color
- Colorless to Yellow to Green
- Water Solubility
- Not miscible in water.
- BRN
- 2042880 · 2042880
- CAS DataBase Reference
- 2893 · 2893-05-2(CAS DataBase Reference)
- FDA UNII
- 81804 S3MKM · 81804S3MKM
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Safety Statements
- 24 · 24/25
- HS Code
- 2914390090 · 2914390090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 2-Butanone, 3-methyl-1-phenyl-
Safety data
- hs_code
- 2914390090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 24/25
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
Uses3-Methyl-1-phenyl-2-butanone is used as pharmaceutical intermediate.
Suppliers32 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
Shanxi Tihondan Pharmaceutical Technology Co., Ltd+8618235132063 · [email protected]
苏州键合化学试剂有限公司0512-69561983 13914027025 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
天津荣燊化工有限公司18317763565; 18317763565 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
南京博米尔生物科技有限公司025-83453382-8005 · [email protected]
广东翁江化学试剂有限公司0751-2886750 13927877953 · [email protected]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
苏州美诺医药科技有限公司0512-69561983 13914027025 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
北京迈瑞达科技有限公司010-82387566 18001021521 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
Aladdin Scientific[email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
南京予善化工有限公司+86-025-025-85281586 18651653755 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
7 records
Compound notes
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