2,2-Dimethyl-3,4-dihydro-2H-1,4-benzoxazine - CAS 866089-28-3
Catalog: |
BB038003 |
Product Name: |
2,2-Dimethyl-3,4-dihydro-2H-1,4-benzoxazine |
CAS: |
866089-28-3 |
Synonyms: |
2,2-dimethyl-3,4-dihydro-1,4-benzoxazine; 2,2-dimethyl-3,4-dihydro-1,4-benzoxazine |
IUPAC Name: | 2,2-dimethyl-3,4-dihydro-1,4-benzoxazine |
Description: | 2,2-Dimethyl-3,4-dihydro-2H-1,4-benzoxazine (CAS# 866089-28-3) is a useful research chemical. |
Molecular Weight: | 163.22 |
Molecular Formula: | C10H13NO |
Canonical SMILES: | CC1(CNC2=CC=CC=C2O1)C |
InChI: | InChI=1S/C10H13NO/c1-10(2)7-11-8-5-3-4-6-9(8)12-10/h3-6,11H,7H2,1-2H3 |
InChI Key: | WILBVUMFTFLAHJ-UHFFFAOYSA-N |
LogP: | 2.40750 |
GHS Hazard Statement: | 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] |
Precautionary Statement: | 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 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3828253-A1 | Low greenhouse gas fuel compositions | 20191129 |
WO-2020260417-A1 | Methods for preparing benzoxazines | 20190626 |
WO-2020127385-A1 | Methods for preparing compounds | 20181219 |
WO-2020127390-A1 | Methods for preparing compounds | 20181219 |
US-2020331869-A1 | Methods for Preparing Fuel Additives | 20171227 |
Complexity: | 167 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 163.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 163.099714038 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 21.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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