N-(2-Hydroxyethyl)(cyclopropylmethyl)amine - CAS 557769-86-5
Catalog: |
BB029174 |
Product Name: |
N-(2-Hydroxyethyl)(cyclopropylmethyl)amine |
CAS: |
557769-86-5 |
Synonyms: |
2-(cyclopropylmethylamino)ethanol; 2-(cyclopropylmethylamino)ethanol |
IUPAC Name: | 2-(cyclopropylmethylamino)ethanol |
Description: | N-(2-Hydroxyethyl)(cyclopropylmethyl)amine (CAS# 557769-86-5) is a useful research chemical. |
Molecular Weight: | 115.17 |
Molecular Formula: | C6H13NO |
Canonical SMILES: | C1CC1CNCCO |
InChI: | InChI=1S/C6H13NO/c8-4-3-7-5-6-1-2-6/h6-8H,1-5H2 |
InChI Key: | HJIGAAUGGJHBMI-UHFFFAOYSA-N |
LogP: | 0.36920 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2019243550-A1 | Thiophene derivatives for the treatment of disorders caused by ige | 20180621 |
EP-3227263-A1 | Cxcr7 receptor modulators | 20141201 |
EP-3227263-B1 | Cxcr7 receptor modulators | 20141201 |
JP-2017535618-A | CXCR7 receptor modulator | 20141201 |
JP-6582056-B2 | CXCR7 receptor modulator | 20141201 |
Complexity: | 61.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 115.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 115.099714038 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 32.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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