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Basic information
- CAS
1218789-35-5- Standard SMILES
CC1(C)OB(c2cnc(NC3CCCCC3)nc2)OC1(C)C- InChIKey
BESJXVWUOFEXIH-UHFFFAOYSA-N- Molecular formula
- C16H26BN3O2
- Average molar mass
- 303.215 g/mol
- Monoisotopic mass
- 303.21180747
Names & identifiers
- Preferred name
- N-Cyclohexyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine
- IUPAC
- N-Cyclohexyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine
- English name
- N-Cyclohexyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine
- Molecular formula
- C16H26BN3O2
- Molecular weight
- 303.21
Names & synonyms
2-(Cyclohexylamino)pyrimidine-5-boronic acid, pinacol esterN-Cyclohexyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine2-Pyrimidinamine,N-cyclohexyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
Database identifiers
- CAS
1218789-35-5- PubChem CID
- 46739655
- DTXSID
DTXSID10675248
Properties
Physicochemical properties
- Boiling point
- 455.3 · 455.3±37.0 °C(Predicted)
- Density
- 1.09 · 1.09±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 3.73 · 3.73±0.10(Predicted)
- form
- solid
- InChI
- 1S/C16H26BN3O2/c1-15(2)16(3,4)22-17(21-15)12-10-18-14(19-11-12)20-13-8-6-5-7-9-13/h10-11,13H,5-9H2,1-4H3,(H,18,19,20)
- InChIKey
- BESJXVWUOFEXIH-UHFFFAOYSA-N
- SMILES
- CC1(OB(C2=CN=C(N=C2)NC3CCCCC3)OC1(C)C)C
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
- HS Code
- 2933599590 · 2933599590
- 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
- hs_code
- 2933599590
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Chemistry & industry
Suppliers16 total
杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
杭州博洛科生物科技有限公司13757158499; 13757158499 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
镇江博润生物医药科技有限公司15862994627 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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