Basic information
- CAS
64996-15-2- Standard SMILES
OCC1CN(Cc2ccccc2)CCC12OCCO2- InChIKey
CPBVGVADXUSNKC-UHFFFAOYSA-N- Molecular formula
- C15H21NO3
- Average molar mass
- 263.33 g/mol
- Monoisotopic mass
- 263.15214353
Names & identifiers
- Preferred name
- (8-Benzyl-1,4-dioxa-8-aza-spiro(4.5)dec-6-YL)-methanol
- IUPAC
- (8-benzyl-1,4-dioxa-8-azaspiro[4.5]decan-6-yl)methanol
- English name
- (8-benzyl-1,4-dioxa-8-azaspiro[4.5]decan-6-yl)Methanol
- Molecular formula
- C15H21NO3
- Molecular weight
- 263.33
Names & synonyms
(8-BENZYL-1,4-DIOXA-8-AZA-SPIRO[4.5]DEC-6-YL)-METHANOL(8-Benzyl-1,4-dioxa-8-aza-spiro(4.5)dec-6-YL)-methanolRefChem:405414651-897-664996-15-2(8-benzyl-1,4-dioxa-8-azaspiro[4.5]decan-6-yl)methanolMFCD00183312{8-benzyl-1,4-dioxa-8-azaspiro[4.5]decan-6-yl}methanolSCHEMBL5871849DTXSID30393679AKOS024330652AB88170
Show more names
1,4-Dioxa-8-azaspiro[4.5]decane-6-methanol, 8-(phenylmethyl)-
AS-30051SY241441DB-336162CS-0207096F300723(8-benzyl-1,4-dioxa-8-azaspiro[4.5]dec-6-yl)methanol(8-Benzyl-1,4-dioxa-8-azaspiro[4.5]decane-6-yl)methanol(8-Benzyl-14-dioxa-8-aza-spiro[4.5]dec-6-yl)-methanol
Database identifiers
- CAS
64996-15-2- PubChem CID
- 3563668
- DTXSID
DTXSID30393679- EC Number
- 651-897-6
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 285
Physicochemical properties
- storage temp.
- Store at Room Tem.
- Symbol(GHS)
- 5 · GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 318 · H318-H315-H335-H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501-P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362
Safety & regulation
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger 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, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06
- Hazard statements
- H318-H315-H335-H301
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501-P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers14 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
安特希（苏州）生物科技有限公司19951207836
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海皓骏医药科技有限公司021-34621078 13120882795 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
上海辰烛医药科技有限公司13162380607 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
武汉赢元贝商贸有限公司86-13349903920 13349903920 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
河南阿尔法化工有限公司0371-55055611 18137792234 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
2 records
Compound notes
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