Basic information
- CAS
538-09-0- Standard SMILES
OC1C[C@H]2CC[C@@H](C1)N2- InChIKey
YYMCYJLIYNNOMK-MEKDEQNOSA-N- Molecular formula
- C7H13NO
- Average molar mass
- 127.18 g/mol
- Monoisotopic mass
- 127.09971404
Names & identifiers
- Preferred name
- Nortropine
- IUPAC
- (1S,5R)-8-azabicyclo[3.2.1]octan-3-ol
- English name
- Nortropine
- Molecular formula
- C7H13NO
- Molecular weight
- 127.18
Names & synonyms
Nortropine538-09-0DTXSID701318429RefChem:854764DTXCID301748240exo-8-Azabicyclo[3.2.1]octan-3-ol501-33-7ENDO-8-AZABICYCLO[3.2.1]OCTAN-3-OL(1R,3R,5S)-8-azabicyclo[3.2.1]octan-3-olMFCD00047140Nortropenol(1r,5s)-8-azabicyclo[3.2.1]octan-3-ol
Show more names
NortropinNSC 72850TropigeninTropigenineNOR-TROPANOL
(1R,3S,5S)-8-AZABICYCLO[3.2.1]OCTAN-3-OL(3-endo)-8-Azabicyclo[3.2.1]octan-3-ol(1S,5R)-8-AZABICYCLO[3.2.1]OCTAN-3-OLMFCD017112478-Azabicyclo(3.2.1)octan-3-ol, endo-Nortropidine, 2,3-dihydro-3-hydroxy-1alpha-H,5alpha-H-Nortropan-3alpha-olNortropeno Hydrochloride
Database identifiers
- CAS
538-09-0- PubChem CID
- 73480
- EC Number
- 700-286-3
- Nikkaji
- J12.188F、J86.691A
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 103
Experimental & physicochemical properties
Kovats Retention Index1160
Physicochemical properties
- Melting point
- 108 · 108-110°C
- Boiling point
- 229.6 °C · 229.6 °C
- Density
- 1.096 · 1.096
- refractive index
- 1.52 · 1.52
- Flash point
- 116.8 °C · 116.8 °C
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- solubility
- DMSO (Slightly), Methanol (Slightly), Water
- form
- Solid
- pka
- 14.89 · 14.89±0.20(Predicted)
- color
- Off-White to Light Beige
- InChI
- InChI=1/C7H13NO/c9-7-3-5-1-2-6(4-7)8-5/h5-9H,1-4H2/t5-,6+,7+
- InChIKey
- YYMCYJLIYNNOMK-ZMONIFLSNA-N
- SMILES
- O[C@@H]1C[C@@H]2CC[C@@H](N2)C1 |&1:1,3,6,r|
- EWG's Food Scores
- 1 · 1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332
- Precautionary statements
- 260 · P260-P280-P301+P312-P302+P352-P304+P340-P361+P364
- RTECS
- 700000 · RD0700000
- HS Code
- 2904200090 · 2904200090
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (75%): Harmful if swallowed [Warning Acute toxicity, oral]；H303 (12.5%): May be harmful if swallowed [Warning Acute toxicity, oral]；H312 (12.5%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H319 (12.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (12.5%): Harmful if inhaled [Warning Acute toxicity, inhalation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 8 reports by companies from 4 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
Regulatory InformationStatus: Active Update: 03-12-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/27381；Status: Active Update: 15-10-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/1042
Hazard Classes and CategoriesAcute Tox. 4 (75%)；Acute Tox. 5 (12.5%)；Acute Tox. 4 (12.5%)；Eye Irrit. 2 (12.5%)；Acute Tox. 4 (12.5%)
Regulatory information
Regulatory InformationStatus: Active Update: 03-12-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/27381；Status: Active Update: 15-10-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/1042
Safety data
- rtecs
- RD0700000
- hs_code
- 2904200090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302+H312+H332
- REACH Registrations
- Active
- Precautionary statements
- P260-P280-P301+P312-P302+P352-P304+P340-P361+P364
Chemistry & industry
Applications
UsesA metabolite of Atropine.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
Shanghai Yingrui Biopharma Co.,Ltd21-33585366 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
上海弘顺生物科技有限公司15901914505 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
石家庄斯迪亚诺精细化工有限公司0311-89250318 13582355795 · [email protected]
广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
Advanced chemblocks inc650-6922368 650-6922368;650-6922368 · [email protected]
上海诗丹德标准技术服务有限公司021-021-57127007-6622-6622 17621252073 · [email protected]
上海相辉医药科技有限公司13761987713 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
合肥天健化工有限公司551-65418679 15856988503;15837135945 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
武汉海正工贸发展有限公司027-8866 0053/88660577/88660578
艾科试剂4008-755-333 18080918076 · [email protected]
上海思域化工科技有限公司86-21-34053660 · [email protected]
南京精瑞久安生物技术有限公司025-58196018 800028039 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
越林试剂021-62960152 · [email protected]
广州爱纯医药科技有限公司020-39119399 18927568969 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
安徽科迪达化工有限公司0554-2106669 · [email protected]
HBCChem, Inc.+1-510-219-6317 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
雷丁试剂0510-85629785 18013409632 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
上海乾劲化工科技有限公司021-20900665 17321230821 · [email protected]
上海永叶生物科技有限公司86-021-61559134 15921386130 · [email protected]
上海洽凡生化科技有限公司+86-021-61654350 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
江苏明化合晟生物科技有限公司0519-85170101 · [email protected]
Accela ChemBio Inc.+1(858) 699-3322 · [email protected]
江苏倍达医药科技有限公司0512-63009836 18994340901 · [email protected]
Additional notes
DefinitionNortropine, also known as Nortropenol, is isolated from the total alkaloids of Convolvulus subhirsutus. This compound is an intermediate in tropine breakdown and reactions leading to succinate.
Related reactions
3 records
Compound notes
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