tert-Butyl 7-Hydroxyheptanoate - CAS 86013-78-7
Catalog: |
BB071648 |
Product Name: |
tert-Butyl 7-Hydroxyheptanoate |
CAS: |
86013-78-7 |
Synonyms: |
tert-butyl 7-hydroxyheptanoate |
IUPAC Name: | tert-butyl 7-hydroxyheptanoate |
Molecular Weight: | 202.29 |
Molecular Formula: | C11H22O3 |
Canonical SMILES: | CC(C)(C)OC(=O)CCCCCCO |
InChI: | InChI=1S/C11H22O3/c1-11(2,3)14-10(13)8-6-4-5-7-9-12/h12H,4-9H2,1-3H3 |
InChI Key: | PKTFZBMGJHDRNG-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/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 |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.15689456 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.15689456 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 46.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS