Basic information
- CAS
28741-07-3- Standard SMILES
CCCCCCCB(O)O- InChIKey
JDHPHWYPXVFZKA-UHFFFAOYSA-N- Molecular formula
- C7H17BO2
- Average molar mass
- 144.02 g/mol
- Monoisotopic mass
- 144.1321599
Names & identifiers
- Preferred name
- Heptylboronic acid
- IUPAC
- heptylboronic acid
- English name
- n-Heptaneboronic acid
- Molecular formula
- C7H17BO2
- Molecular weight
- 144.02
Names & synonyms
HEPTYLBORONIC ACID28741-07-3DTXSID10567679RefChem:347318DTXCID00518453N-Heptylboronic acidN-HEPTANEBORONIC ACIDMFCD06201026Boronic acid, heptyl-Boronic acid, B-heptyl-N-HEPTANEBORONICACIDC7H17BO2
Show more names
N-Heptylboronic acid≥ 97% (assay)
HEPTYLBORONICACID1-HEPTANEBORONIC ACIDSCHEMBL3277101AKOS013013910AB23085DS-8293N-Heptylboronic acid>/= 97% (assay)SY102905
Database identifiers
- CAS
28741-07-3- PubChem CID
- 15061385
- DTXSID
DTXSID10567679- Nikkaji
- J2.467.036H
Properties
Computed structural properties
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 66.6
Physicochemical properties
- Boiling point
- 244.744 · 244.744±23.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.894 · 0.894±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- -20 °C · Inert atmosphere,Store in freezer, under -20°C
- pka
- 10.194 · 10.194±0.10(predicted)
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C7H17BO2/c1-3-4-5-6-7(2)8(9)10/h7,9-10H,3-6H2,1-2H3
- InChIKey
- GZDXOIBYOWDWKV-UHFFFAOYSA-N
- SMILES
- CC(B(O)O)CCCCC
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 303 · H303-H320
- Precautionary statements
- 312 · P312-P264-P305+P351+P338-P337+P313
- HS Code
- 2931900090 · 2931900090
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
- 2931900090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H303-H320
- Precautionary statements
- P312-P264-P305+P351+P338-P337+P313
Chemistry & industry
Applications
UsesHeptylboronic acid is an inhibitor of α-chymotrypsin.
Suppliers42 total
临沂锎源化学科技有限公司13188735557 · [email protected]
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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