3-(Methylamino)butan-1-ol - CAS 2704-55-4
Catalog: |
BB053564 |
Product Name: |
3-(Methylamino)butan-1-ol |
CAS: |
2704-55-4 |
Synonyms: |
3-(Methylamino)-1-butanol; 3-methylamino-butan-1-ol; 3-methylamino-1-butanol |
IUPAC Name: | 3-(methylamino)butan-1-ol |
Molecular Weight: | 103.16 |
Molecular Formula: | C5H13NO |
Canonical SMILES: | CC(CCO)NC |
InChI: | InChI=1S/C5H13NO/c1-5(6-2)3-4-7/h5-7H,3-4H2,1-2H3 |
InChI Key: | HNNZBZKURNBXOO-UHFFFAOYSA-N |
Boiling Point: | 169.8±23.0 °C at 760 mmHg |
Purity: | 95% |
Density: | 0.9±0.1 g/cm3 |
Appearance: | Pale Yellow Oil |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H318 (100%): Causes serious eye damage [Danger 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+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Danger |
Complexity: | 39.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 103.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 103.099714038 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 32.3 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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