Basic information
- CAS
1384265-35-3- Standard SMILES
CC(C)(C)OC(=O)N1CCC2(CC1)CC(CC(=O)O)C2- InChIKey
LTQHZBPBTVFUHG-UHFFFAOYSA-N- Molecular formula
- C15H25NO4
- Average molar mass
- 283.36 g/mol
- Monoisotopic mass
- 283.17835828
Names & identifiers
- Preferred name
- 2-(7-((Tert-butoxy)carbonyl)-7-azaspiro(3.5)nonan-2-yl)acetic acid
- IUPAC
- 2-[7-[(2-methylpropan-2-yl)oxycarbonyl]-7-azaspiro[3.5]nonan-2-yl]acetic acid
- English name
- 2-(7-(tert-butoxycarbonyl)-7-azaspiro[3.5]nonan-2-yl)acetic acid
- Molecular formula
- C15H25NO4
- Molecular weight
- 283.36
Names & synonyms
1384265-35-32-{7-[(tert-butoxy)carbonyl]-7-azaspiro[3.5]nonan-2-yl}acetic acid2-(7-((Tert-butoxy)carbonyl)-7-azaspiro(3.5)nonan-2-yl)acetic acidRefChem:459295969-741-32-(7-(tert-Butoxycarbonyl)-7-azaspiro[3.5]nonan-2-yl)acetic acid2-(7-BOC-7-AZASPIRO[3.5]NONAN-2-YL)ACETIC ACIDMFCD225736842-[7-[(2-methylpropan-2-yl)oxycarbonyl]-7-azaspiro[3.5]nonan-2-yl]acetic acidorb3176112SCHEMBL6749163LTQHZBPBTVFUHG-UHFFFAOYSA-N
Show more names
[7-(tert-butoxycarbonyl)-7-azaspiro[3.5]non-2-yl]acetic acid7-Azaspiro[3.5]nonane-2-acetic acid, 7-[(1,1-dimethylethoxy)carbonyl]-2-Carboxymethyl-7-aza-spiro[3.5]nonane-7-carboxylic acid tert-butyl ester2-{7-[(tert-butoxy)carbonyl]-7-azaspiro[3.5]nonan-2-yl}acetic acid - [B82670]
JFC26535AKOS027329839BS-43348SY324068CS-03342687-Boc-7-azaspiro[3.5]nonane-2-acetic AcidF3028162-[7-[(2-methylpropan-2-yl)oxycarbonyl]-7-azaspiro[3.5]
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 383
Physicochemical properties
- Boiling point
- 424.7 · 424.7±18.0 °C(Predicted)
- Density
- 1.16 · 1.16±0.1 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- 4.67 · 4.67±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers21 total
奥夫仑医药（四川）有限公司17336178085 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Aladdin Scientific[email protected]
台州南峰药物研究所[email protected] 18616377689 · [email protected]
天津福瑞凯科技有限公司15602163079 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海修时生物医药有限公司15002184385 15021598081 15002184385 · [email protected]
上海新作博生物医药科技有限公司021-18800336901 15821600833
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
南京合巨药业有限公司025-57027686 17372956142 · [email protected]
安徽敬同药业股份有限公司13675155016 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
2 records
Compound notes
Loading…