2-Cyclopropyl-1,3-benzoxazol-6-amine - CAS 1039335-05-1
Catalog: |
BB073092 |
Product Name: |
2-Cyclopropyl-1,3-benzoxazol-6-amine |
CAS: |
1039335-05-1 |
Synonyms: |
2-cyclopropyl-1,3-benzoxazol-6-amine; 2-Cyclopropylbenzo[d]oxazol-6-amine |
IUPAC Name: | 2-cyclopropyl-1,3-benzoxazol-6-amine |
Molecular Weight: | 174.2 |
Molecular Formula: | C10H10N2O |
Canonical SMILES: | C1CC1C2=NC3=C(O2)C=C(C=C3)N |
InChI: | InChI=1S/C10H10N2O/c11-7-3-4-8-9(5-7)13-10(12-8)6-1-2-6/h3-6H,1-2,11H2 |
InChI Key: | ZXHKSGMKRLUKHC-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 205 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 174.079312947 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 174.079312947 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 52Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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