(4S)-8-chloro-3,4-dihydro-2H-1-benzopyran-4-amine

(4S)-8-chloro-3,4-dihydro-2H-1-benzopyran-4-amine

CAS: 1228542-35-5

Formula: C9H10ClNO

SMILES: N[C@H]1CCOC2=C1C=CC=C2Cl

IUPAC: (4S)-8-chloro-3,4-dihydro-2H-1-benzopyran-4-amine

InChI: InChI=1S/C9H10ClNO/c10-7-3-1-2-6-8(11)4-5-12-9(6)7/h1-3,8H,4-5,11H2/t8-/m0/s1

Composition: C (58.87%), H (5.49%), Cl (19.30%), N (7.63%), O (8.71%)

Molar Mass: 183.64

Atom Count: 22

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	183.0450916
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	YCWHOLRRUIEVQK-QMMMGPOBSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.37
Topological Polar Surface Area	35.25
Polarizability	19.21
Ring Count	2
Rotatable Bond Count	0

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