Basic information
- CAS
207922-56-3- Standard SMILES
COC(=O)Nc1ccc(Br)cn1- InChIKey
XYBRWUNZRUBCGY-UHFFFAOYSA-N- Molecular formula
- C7H7BrN2O2
- Average molar mass
- 231.05 g/mol
- Monoisotopic mass
- 229.96909
Names & identifiers
- Preferred name
- Methyl (5-bromopyridin-2-yl)carbamate
- IUPAC
- methyl N-(5-bromo-2-pyridinyl)carbamate
- English name
- Methyl 5-bromopyridin-2-ylcarbamate
- Molecular formula
- C7H7BrN2O2
- Molecular weight
- 231.05
Names & synonyms
207922-56-3methyl (5-bromopyridin-2-yl)carbamateDTXSID70355079RefChem:353095DTXCID403061395-BROMO-2-(METHOXYCARBONYLAMINO)PYRIDINEmethyl N-(5-bromopyridin-2-yl)carbamateMFCD00739213TimTec1_005418SCHEMBL5689000CHEMBL4889390HMS1549G06
Show more names
Methyl 5-bromopyridin-2-ylcarbamate
(5-Bromo-pyridin-2-yl)-carbamic acid methyl esterCarbamic acid, N-(5-bromo-2-pyridinyl)-, methyl estermethyl 5-bromo-2-pyridinylcarbamateSTK733512methyl(5-bromopyridin-2-yl)carbamateAKOS000597907CCG-340039MB01437
Database identifiers
- CAS
207922-56-3- PubChem CID
- 790797
- DTXSID
DTXSID70355079- ChEMBL
CHEMBL4889390- Nikkaji
- J1.215.693F
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 165
Physicochemical properties
- Boiling point
- 249.1 · 249.1±25.0 °C(Predicted)
- Density
- 1.67 · 1.670±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- pka
- 11.68 · 11.68±0.70(Predicted)
- HS Code
- 2933399990 · 2933399990
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
- 2933399990
Chemistry & industry
Suppliers14 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Compound Net Biotechnology Inc.15266686121 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [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]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
上海尊理加生命科技有限公司021-34045219 13062664914 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
上海雷祺生物科技有限公司18621609968 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
上海祺弘医药科技有限公司13482681346 18117455885 · [email protected]
Related reactions
5 records
Compound notes
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