Basic information
- CAS
2166952-44-7- Standard SMILES
O=CC12CC(NC(=O)OCc3ccccc3)(C1)C2- InChIKey
GVZYCBBXQISDCT-UHFFFAOYSA-N- Molecular formula
- C14H15NO3
- Average molar mass
- 245.27 g/mol
- Monoisotopic mass
- 245.10519334
Names & identifiers
- Preferred name
- benzyl N-{3-formylbicyclo[1.1.1]pentan-1-yl}carbamate
- IUPAC
- benzyl N-(3-formyl-1-bicyclo[1.1.1]pentanyl)carbamate
- English name
- benzyl (3-formylbicyclo[1.1.1]pentan-1-yl)carbamate
- Molecular formula
- C14H15NO3
- Molecular weight
- 245.2738
Names & synonyms
2166952-44-7benzyl N-{3-formylbicyclo[1.1.1]pentan-1-yl}carbamatebenzyl (3-formylbicyclo[1.1.1]pentan-1-yl)carbamateMFCD31620791benzyl N-(3-formyl-1-bicyclo[1.1.1]pentanyl)carbamatebenzyl n-(3-formylbicyclo[1.1.1]pentan-1-yl)carbamateSCHEMBL26103025AS-780931-(Cbz-amino)formylbicyclo[1.1.1]pentaneCS-0059102P18590F614427
Show more names
benzylN-{3-formylbicyclo[1.1.1]pentan-1-yl}carbamateBENZYL N-{3-FORMYLBICYCLO[1.1.1]PENTAN-1-YLCARBAMATE
Database identifiers
- CAS
2166952-44-7- PubChem CID
- 132352769
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 340
Physicochemical properties
- storage temp.
- -20 °C, · -20°C, stored under nitrogen
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Chemistry & industry
Suppliers11 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
安庆融创生物科技有限公司15001988657 · [email protected]
Chongqing jooe co., ltd+86-15223382610 · [email protected]
天津福瑞凯科技有限公司15602163079 · [email protected]
南京合巨药业有限公司25-57027686 17372956142 · [email protected]
上海旺珐化工科技有限公司（安徽珐诺伊医药科技有限公司）13918479294 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海进取者生物医药科技有限公司19121164345; 1 · [email protected]
誉通医药科技（苏州）有限公司0512-15851462628 15851462628 · [email protected]
南京药石科技股份有限公司4000255188 13327728092 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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