Basic information
- CAS
114747-44-3- Standard SMILES
CN1c2ccccc2C(C)(C)C12C=Nc1c(cc(N3CCc4ccccc43)c3ccccc13)O2- InChIKey
PITZBBWQUBGWTD-UHFFFAOYSA-N- Molecular formula
- C30H27N3O
- Average molar mass
- 445.6 g/mol
- Monoisotopic mass
- 445.21541248
Names & identifiers
- Preferred name
- Spiro[2H-indole-2,3'-[3H]naphth[2,1-b][1,4]oxazine], 6'-(2,3-dihydro-1H-indol-1-yl)-1,3-dihydro-1,3,3-trimethyl-
- IUPAC
- 6-(2,3-dihydroindol-1-yl)-1',3',3'-trimethylspiro[benzo[f][1,4]benzoxazine-3,2'-indole]
- English name
- Spiro(2H-indole-2,3'-(3H)naphth(2,1-B)(1,4)oxazine), 6'-(2,3-dihydro-1H-indol-1-yl)-1,3-dihydro-1,3,3-trimethyl-
- Molecular formula
- C30H27N3O
- Molecular weight
- 445.55
Names & synonyms
114747-44-3DTXSID70888872Spiro[2H-indole-2,3'-[3H]naphth[2,1-b][1,4]oxazine], 6'-(2,3-dihydro-1H-indol-1-yl)-1,3-dihydro-1,3,3-trimethyl-Spiro(2H-indole-2,3'-(3H)naphth(2,1-b)(1,4)oxazine), 6'-(2,3-dihydro-1H-indol-1-yl)-1,3-dihydro-1,3,3-trimethyl-Spiro[2H-indole-2,3'-(3H)naphth[2,1-b][1,4]oxazine], 6'-(2,3-dihydro-1H-indol-1-yl)-1,3-dihydro-1,3,3-trimethyl-RefChem:888806DTXCID901028143601-320-96'-(Indolin-1-yl)-1,3,3-trimethylspiro[indoline-2,3'-naphtho[2,1-b][1,4]oxazine]Sunny Color 3MFCD00329019C30H27N3O
Show more names
Sunny Color 3 Purple6'--(indolin-1-yl)-1,3,3-trimethylspiro【indoline-2,3'-nap6'-Indolino-1,3,3-trimethylspiro[indoline-2,3'-3H-naphth[2,1-b][1,4]oxazine]6’-(1-Indolinyl)-1,3,3-trimethylspiro[indoline-2,3’-naphtho[2,1-b][1,4]oxazine6'-(Indolin-1-yl)-1,3,3-trimethylspiro[indoline-2,3'-naphtho[2,1-b][1,4]oxazine
6-(2,3-dihydroindol-1-yl)-1',3',3'-trimethylspiro[benzo[f][1,4]benzoxazine-3,2'-indole]6'-(2,3-dihydro-1H-indol-1-yl)-1,3,3-trimethyl-1,3-dihydrospiro[indole-2,3'-naphtho[2,1-b][1,4]oxazine]6'-(2,3-Dihydro-1H-indol-1-yl)-1,3-dihydro-1,3,3-trimethylspiro[2H-indole-2,3'-[3H]naphth[2,1-b][1,4]oxazine]ChemDiv1_019241SCHEMBL4621948HMS641K13AKOS001590142AKOS021983651
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 28.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 811
Physicochemical properties
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Cosmetics Ingredients Functions
- COLORANT
- InChI
- InChI=1S/C30H27N3O/c1-29(2)23-13-7-9-15-25(23)32(3)30(29)19-31-28-22-12-6-5-11-21(22)26(18-27(28)34-30)33-17-16-20-10-4-8-14-24(20)33/h4-15,18-19H,16-17H2,1-3H3
- InChIKey
- PITZBBWQUBGWTD-UHFFFAOYSA-N
- SMILES
- N1(C)C2=C(C=CC=C2)C(C)(C)C21C=NC1=C3C(C=CC=C3)=C(N3C4=C(C=CC=C4)CC3)C=C1O2
- EPA Substance Registry System
- 2 H-indole-2,3'-[3H]naphth[2,1-b][1,4]oxazine], · Spiro[2H-indole-2,3'-[3H]naphth[2,1-b][1,4]oxazine], 6'-(2,3-dihydro-1H-indol-1-yl)-1,3-dihydro-1,3,3-trimethyl- (114747-44-3)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- TSCA
- TSCA listed
Safety & regulation
GHS classification
GHS Classification
H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, P391, 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
Regulatory Information
Chemical: Spiro[2H-indole-2,3'-(3H)naphth[2,1-b][1,4]oxazine], 6'-(2,3-dihydro-1H-indol-1-yl)-1,3-dihydro-1,3,3-trimethyl-
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesAquatic Chronic 2 (100%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationSpiro[2H-indole-2,3'-[3H]naphth[2,1-b][1,4]oxazine], 6'-(2,3-dihydro-1H-indol-1-yl)-1,3-dihydro-1,3,3-trimethyl-: ACTIVE
Upstream & downstream products
Upstream raw materials
Suppliers31 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
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]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
Related reactions
1 records
Compound notes
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