| CAS Number | 763907-56-8 |
| Catalog Number | AG00GA7X(AGN-PC-0WOJ80) |
| Chemical Name | 7-chloro-3,4-dihydro-2H-chroMen-4-aMine |
| IUPAC Name | 7-chloro-3,4-dihydro-2H-chromen-4-amine |
| InChI | InChI=1S/C9H10ClNO/c10-6-1-2-7-8(11)3-4-12-9(7)5-6/h1-2,5,8H,3-4,11H2 |
| InChI Key | ZKRTWXXJEXSHCT-UHFFFAOYSA-N |
| MDL Number | MFCD17010010 |
| Molecular Formula | C9H10ClNO |
| Molecular Weight | 183.6348 |
| SMILES | NC1CCOC2=C1C=CC(Cl)=C2 |
| Synonyms | 7-CHLOROCHROMAN-4-AMINE,
763907-56-8,
(R)-7-Chlorochroman-4-amine,
(S)-7-Chlorochroman-4-amine,
7-chloro-3,4-dihydro-2H-chromen-4-amine,
SCHEMBL3603065,
1213320-82-1,
AKOS017518068,
MB69092,
7-CHLORO-3,4-DIHYDRO-2H-1-BENZOPYRAN-4-AMINE,
1057246-81-7,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.635g/mol |
| Monoisotopic Mass | 183.045g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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\N
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Hazard statements
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H315-H319
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Packing Group
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\N
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Precautionary statements
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P264-P280-P302+P352-P305+P351+P338-P321-P332+P313-P337+P313-P362
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UN Code
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\N
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Certificate of Analysis
Lot Number